Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.65 |
| ▸ | EIF4E | P06730 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | MERTK | Q12866 | 2/20 | 0.41 |
| ▸ | PTPRC | P08575 | 1/20 | 0.41 |
| ▸ | S100A4 | P26447 | 1/20 | 0.41 |
| ▸ | FBP1 | P09467 | 1/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8499255 | 0.90 | ALDH1A1 (0.61) | ALDH1A1TDP1EIF4EHPGDVCAM1 | |
| SCHEMBL11235678 | 0.83 | ALDH1A1 (0.65) | ALDH1A1TDP1HPGDL3MBTL1ADAMTS4 | |
| SCHEMBL27806615 | 0.81 | VCAM1 (0.58) | ALDH1A1TDP1EIF4EVCAM1MAPT | |
| Water SCHEMBL2045405 | 0.81 | ALDH1A1 (0.96) | ALDH1A1TDP1HPGDL3MBTL1ADAMTS4 | |
| Water SCHEMBL1828402 | 0.81 | ALDH1A1 (0.96) | ALDH1A1TDP1HPGDL3MBTL1ADAMTS4 | |
| Water SCHEMBL28773684 | 0.80 | ALDH1A1 (0.71) | ALDH1A1TDP1HPGDL3MBTL1ADAMTS4 | |
| SCHEMBL1027644 | 0.80 | VCAM1 (0.57) | ALDH1A1TDP1EIF4EHPGDVCAM1 | |
| Benzonitrile SCHEMBL27372818 | 0.80 | TSHR (0.58) | ALDH1A1TDP1HPGDVCAM1MAPT | |
| SCHEMBL2958562 | 0.80 | ALDH1A1 (0.92) | ALDH1A1TDP1L3MBTL1ADAMTS4PTPN1 | |
| SCHEMBL44392 | 0.79 | ALDH1A1 (1.00) | ALDH1A1TDP1L3MBTL1ADAMTS4PTPN1 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107501099-A | The adjusting control agent of ATP combination cassette transporters | 沃泰克斯药物股份有限公司 | 2017-12-22 | — | — | CN | disclosed |
| CN-104788328-B | The adjusting control agent of ATP combination cassette transporters | 沃泰克斯药物股份有限公司 | 2017-09-12 | — | — | CN | disclosed |
| US-9296899-B2 | Phthalocyanine crystal, and electrophotographic photoreceptor, electrophotographic photoreceptor cartridge and image-forming device using the same | MITSUBISHI CHEMICAL CORPORATION (JP) | 2016-03-29 | — | — | US | disclosed |
| US-8846282-B2 | Phthalocyanine crystal, and electrophotographic photoreceptor, electrophotographic photoreceptor cartridge and image-forming device using the same | MITSUBISHI CHEMICAL CORPORATION (JP) | 2014-09-30 | — | — | US | disclosed |
| CN-102056894-A | Homocysteine synthase inhibitor | MITSUBISHI TANABE PHARMA CORP | 2011-05-11 | — | — | CN | disclosed |
| CN-101935301-A | Modulators of ATP-binding cassette transporters | VERTEX PHARMA | 2011-01-05 | — | — | CN | disclosed |
| CN-101891680-A | The adjusting control agent of ATP- combination cassette transporters | VERTEX PHARMA | 2010-11-24 | — | — | CN | disclosed |
| EP-1037886-B1 | TRIAZINE ANGIOGENESIS INHIBITORS | ABBOTT LAB (US) | 2003-05-02 | — | — | EP | disclosed |
| US-6288228-B1 | DIAMINOTRIAZINE DERIVATIVES | ABBOTT LABORATORIES | 2001-09-11 | — | — | US | disclosed |
| US-6150362-A | ADMINISTERING 1,3,5-SUBSTITUTED TRIAZINE COMPOUNDS TO THE PATIENT SUFFERING FROM ANGIOGENIC DISEASES | ABBVIE INC. | 2000-11-21 | — | — | US | disclosed |
| US-5264512-A | Amorphous copolymers, transparent in the visible range, for non-linear optical applications | THOMSON-CSF (FR) | 1993-11-23 | — | — | US | disclosed |