Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.50 |
| ▸ | DAO | P14920 | 1/20 | 0.50 |
| ▸ | DDO | Q99489 | 1/20 | 0.50 |
| ▸ | GPR3 | P46089 | 1/20 | 0.50 |
| ▸ | KIF11 | P52732 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3092106 | 0.84 | GAA (0.57) | AHRALDH1A1HSD17B10DAODDO | |
| SCHEMBL7195762 | 0.78 | AHR (0.70) | AHRALDH1A1HSD17B10DAODDO | |
| SCHEMBL154593 | 0.76 | AHR (1.00) | AHRALDH1A1HSD17B10DAODDO | |
| SCHEMBL29420757 | 0.76 | AHR (1.00) | AHRALDH1A1HSD17B10DAODDO | |
| Hydrochloric Acid SCHEMBL8462943 | 0.76 | AHR (0.59) | AHRALDH1A1HSD17B10DAODDO | |
| SCHEMBL3228514 | 0.73 | ALDH1A1 (0.50) | AHRALDH1A1HSD17B10GPR3KIF11 | |
| SCHEMBL6817362 | 0.73 | AHR (0.61) | AHRALDH1A1HSD17B10DAODDO | |
| SCHEMBL21260226 | 0.73 | AHR (0.61) | AHRALDH1A1HSD17B10DAODDO | |
| SCHEMBL7897739 | 0.73 | AHR (0.61) | AHRALDH1A1HSD17B10DAODDO | |
| SCHEMBL7495864 | 0.73 | AHR (0.61) | AHRALDH1A1HSD17B10DAODDO |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6194451-B1 | PREVENT RELEASE TUMOR NECROSIS FACTOR; ANTIINFLAMMATORY AGENTS | PHARMACIA & UPJOHN S.P.A. (IT) | 2001-02-27 | — | — | US | claimed |
| CN-105555763-B | indole-carboxamide derivatives | 豪夫迈·罗氏有限公司 | 2018-04-17 | — | — | CN | disclosed |
| CN-105308024-B | The nitrogenous heteroaromatic amide compound of two ring types | 安斯泰来制药株式会社 | 2017-10-27 | — | — | CN | disclosed |
| CN-105246895-B | Piperazino [1, 2-a ] indol-1-ones and [1, 4] diazacyclo [1, 2-a ] indol-1-ones | 豪夫迈·罗氏有限公司 | 2017-09-22 | — | — | CN | disclosed |
| CN-104540829-B | Piperazino[1,2-a]indol-1-ones and [1,4]diazepino[1,2-a]indol-1-one | 霍夫曼-拉罗奇有限公司 | 2017-04-26 | — | — | CN | disclosed |
| WO-2008104756-A1 | UREA DERIVATIVES AND THEIR THERAPEUTIC USE | SERENTIS LIMITED (GB) | 2008-09-04 | — | — | WO | disclosed |
| EP-0722436-A4 | MERCAPTOSULFIDE METALLOPROTEINASE INHIBITORS | UNIV FLORIDA STATE (US) | 1996-11-20 | — | — | EP | disclosed |
| EP-0722436-A1 | MERCAPTOSULFIDE METALLOPROTEINASE INHIBITORS | FLORIDA STATE UNIVERSITY (US) | 1996-07-24 | — | — | EP | disclosed |
| WO-1995009833-A1 | MERCAPTOSULFIDE METALLOPROTEINASE INHIBITORS | FLORIDA STATE UNIVERSITY (US) | 1995-04-13 | — | — | WO | disclosed |