Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.54 |
| ▸ | FAAH | O00519 | 6/20 | 0.52 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 4/20 | 0.46 |
| ▸ | CES1 | P23141 | 4/20 | 0.46 |
| ▸ | CASP2 | P42575 | 1/20 | 0.45 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.44 |
| ▸ | FNTA | P49354 | 1/20 | 0.44 |
| ▸ | FNTB | P49356 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.43 |
| ▸ | PPARG | P37231 | 2/20 | 0.43 |
| ▸ | PPARD | Q03181 | 2/20 | 0.43 |
| ▸ | PPARA | Q07869 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21060856 | 0.98 | HSP90AA1 (0.57) | HSP90AA1FAAHEPHX2MEN1MAPK1 | |
| SCHEMBL11649466 | 0.98 | HSP90AA1 (0.57) | HSP90AA1FAAHEPHX2MEN1MAPK1 | |
| SCHEMBL7184916 | 0.98 | HSP90AA1 (0.57) | HSP90AA1FAAHEPHX2MEN1MAPK1 | |
| SCHEMBL28194397 | 0.98 | HSP90AA1 (0.52) | HSP90AA1FAAHEPHX2MEN1MAPK1 | |
| SCHEMBL7185340 | 0.98 | HSP90AA1 (0.57) | HSP90AA1FAAHEPHX2MEN1MAPK1 | |
| SCHEMBL3477319 | 0.93 | FNTA (0.46) | HSP90AA1FAAHEPHX2MEN1MAPK1 | |
| SCHEMBL177558 | 0.84 | HDAC3 (0.50) | EPHX2MEN1KMT2ACES2CES1 | |
| SCHEMBL2810388 | 0.83 | EPHX2 (0.62) | HSP90AA1FAAHEPHX2MEN1MAPK1 | |
| SCHEMBL2807682 | 0.83 | HSP90AA1 (0.54) | HSP90AA1FAAHEPHX2MEN1MAPK1 | |
| Dodecanoate SCHEMBL29129545 | 0.82 | FABP3 (0.51) | HSP90AA1EPHX2CES2CES1CASP2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101830497-B | Supergravity hydrothermal preparation method of spherical inorganic powder grains | UNIV TONGJI | 2012-06-06 | — | — | CN | claimed |
| CN-102356066-A | Novel 2,6-substituted-3-nitropyridine derivative, method for preparing same, and pharmaceutical composition including same | DONG WHA PHARM CO LTD | 2012-02-15 | — | — | CN | claimed |
| CN-101830497-A | Supergravity hydrothermal preparation method of spherical inorganic powder grains | UNIV TONGJI | 2010-09-15 | — | — | CN | claimed |
| CN-101801967-A | Novel benzamidine derivatives, process for the preparation thereof and pharmaceutical composition for preventing or treating osteoporosis comprising the same | DONG WHA PHARM IND CO LTD | 2010-08-11 | — | — | CN | claimed |
| CN-101379049-A | Novel benzamidine derivatives, process for preparing the same, and pharmaceutical composition comprising the same | DONG WHA PHARM IND CO LTD (KR) | 2009-03-04 | — | — | CN | claimed |
| CN-101010308-A | Novel benzamidine derivatives, process for the preparation thereof and pharmaceutical composition comprising the same | DONG WHA PHARM IND CO LTD (KR) | 2007-08-01 | — | — | CN | claimed |
| US-6583130-B1 | Substituted with acyl, oxycarbonyl, aminocarbonyl, sulfonyl, or aminosulfonyl; inhibit steroid sulfatase, do not exhibit any estrogenic effect and will not yield any estrogenic products on hydrolysis; treatment of estrogen-dependent tumors | SCHERING AG (DE) | 2003-06-24 | — | — | US | claimed |
| CN-109988151-A | A kind of acetylene compound, preparation method and applications | 北京赛特明强医药科技有限公司 | 2019-07-09 | — | — | CN | disclosed |
| CN-101830497-B | Supergravity hydrothermal preparation method of spherical inorganic powder grains | UNIV TONGJI | 2012-06-06 | — | — | CN | disclosed |
| CN-102356066-A | Novel 2,6-substituted-3-nitropyridine derivative, method for preparing same, and pharmaceutical composition including same | DONG WHA PHARM CO LTD | 2012-02-15 | — | — | CN | disclosed |
| CN-101379049-B | Novel benzamidine derivatives, process for preparing the same, and pharmaceutical composition comprising the same | DONG WHA PHARM IND CO LTD | 2012-01-04 | — | — | CN | disclosed |
| CN-101830497-A | Supergravity hydrothermal preparation method of spherical inorganic powder grains | UNIV TONGJI | 2010-09-15 | — | — | CN | disclosed |
| CN-101801967-A | Novel benzamidine derivatives, process for the preparation thereof and pharmaceutical composition for preventing or treating osteoporosis comprising the same | DONG WHA PHARM IND CO LTD | 2010-08-11 | — | — | CN | disclosed |
| CN-101379049-A | Novel benzamidine derivatives, process for preparing the same, and pharmaceutical composition comprising the same | DONG WHA PHARM IND CO LTD (KR) | 2009-03-04 | — | — | CN | disclosed |
| CN-101010308-A | Novel benzamidine derivatives, process for the preparation thereof and pharmaceutical composition comprising the same | DONG WHA PHARM IND CO LTD (KR) | 2007-08-01 | — | — | CN | disclosed |
| US-6583130-B1 | Substituted with acyl, oxycarbonyl, aminocarbonyl, sulfonyl, or aminosulfonyl; inhibit steroid sulfatase, do not exhibit any estrogenic effect and will not yield any estrogenic products on hydrolysis; treatment of estrogen-dependent tumors | SCHERING AG (DE) | 2003-06-24 | — | — | US | disclosed |