Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | PLAU | P00749 | 2/20 | 0.45 |
| ▸ | PLAT | P00750 | 2/20 | 0.45 |
| ▸ | F2 | P00734 | 1/20 | 0.45 |
| ▸ | F10 | P00742 | 1/20 | 0.45 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.45 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.45 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.45 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 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 | |
|---|---|---|---|---|
| SCHEMBL236867 | 0.85 | ALDH1A1 (0.52) | ALDH1A1TSHRCES2CES1ALOX15 | |
| SCHEMBL29499766 | 0.82 | TSHR (0.65) | ALDH1A1KLKB1TSHRCES2CES1 | |
| SCHEMBL372307 | 0.82 | TSHR (0.65) | ALDH1A1KLKB1TSHRCES2CES1 | |
| SCHEMBL3607272 | 0.81 | KLKB1 (0.61) | ALDH1A1KLKB1PLAUPLATF2 | |
| SCHEMBL431965 | 0.80 | TSHR (0.63) | ALDH1A1KLKB1TSHRCES2CES1 | |
| SCHEMBL10779351 | 0.80 | TSHR (0.63) | ALDH1A1KLKB1TSHRCES2CES1 | |
| SCHEMBL425111 | 0.80 | TSHR (0.63) | ALDH1A1KLKB1TSHRCES2CES1 | |
| SCHEMBL30779693 | 0.80 | KLKB1 (0.51) | ALDH1A1KLKB1TSHRCES2CES1 | |
| SCHEMBL421701 | 0.80 | KLKB1 (0.51) | ALDH1A1KLKB1TSHRCES2CES1 | |
| SCHEMBL2522829 | 0.80 | KLKB1 (0.51) | ALDH1A1KLKB1TSHRCES2CES1 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108395406-A | A kind of benzimidazolone AS-BI production technologies | 中卫市创科知识产权投资有限公司 | 2018-08-14 | — | — | CN | claimed |
| CN-108395406-A | A kind of benzimidazolone AS-BI production technologies | 中卫市创科知识产权投资有限公司 | 2018-08-14 | — | — | CN | disclosed |
| CN-103275034-B | Preparation method of micromolecule cathepsin D inhibitor | NANJING UNIVERSITY OF TECHNOLOGY | 2015-07-08 | — | — | CN | disclosed |
| CN-103992336-A | Oxa- or thio-evodiamine anti-tumor derivatives and preparation method thereof | UNIV PLA 2ND MILITARY MEDICAL | 2014-08-20 | — | — | CN | disclosed |
| CN-103275034-A | Preparation method of micromolecule cathepsin D inhibitor | NANJING UNIVERSITY OF TECHNOLOGY | 2013-09-04 | — | — | CN | disclosed |
| CN-102206152-A | Method for chemically synthesizing 3,5-diio-2-hydroxybenzene formyl chloride | ZHEJIANG RONGYAO CHEMICAL CO LTD | 2011-10-05 | — | — | CN | disclosed |
| EP-0778821-B1 | ORTHO-SUBSTITUTED AROMATIC ETHER COMPOUNDS AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS FOR PAIN RELIEF | ZENECA LTD (GB) | 1999-10-20 | — | — | EP | disclosed |
| US-5965741-A | ANTIINFLAMMATORY, ANTIPYRETIC AND ANTIDIARRHOEAL PROPERTIES | ZENECA LIMITED (GB) | 1999-10-12 | — | — | US | disclosed |
| EP-0778821-A1 | ORTHO-SUBSTITUTED AROMATIC ETHER COMPOUNDS AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS FOR PAIN RELIEF | ZENECA LIMITED (GB) | 1997-06-18 | — | — | EP | disclosed |
| WO-1996006822-A1 | ORTHO-SUBSTITUTED AROMATIC ETHER COMPOUNDS AND THEIR USE IN PHARMACEUTICAL COMPOSITIONS FOR PAIN RELIEF | ZENECA LIMITED (GB) | 1996-03-07 | — | — | WO | disclosed |