Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | CASP1 | P29466 | 2/20 | 0.38 |
| ▸ | CASP7 | P55210 | 2/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13425012 | 0.91 | ALDH1A1 (0.47) | ALDH1A1TSHRKDM4EKMT2AHSD17B10 | |
| SCHEMBL12345965 | 0.85 | ALDH1A1 (0.43) | ALDH1A1TSHRKDM4EKMT2AHSD17B10 | |
| SCHEMBL1885602 | 0.85 | ALDH1A1 (0.55) | ALDH1A1TSHRKDM4EKMT2AHSD17B10 | |
| SCHEMBL30446730 | 0.85 | ALDH1A1 (0.55) | ALDH1A1TSHRKDM4EKMT2AHSD17B10 | |
| SCHEMBL13483671 | 0.83 | TSHR (0.43) | ALDH1A1TSHRKDM4EKMT2ARAB9A | |
| SCHEMBL13241999 | 0.82 | APP (0.46) | ALDH1A1TSHRKDM4EKMT2APKM | |
| SCHEMBL76833 | 0.82 | ESR2 (0.47) | ALDH1A1TSHRKDM4EKMT2ARAB9A | |
| SCHEMBL9150307 | 0.82 | CYP19A1 (0.48) | ALDH1A1TSHRKDM4EKMT2ARAB9A | |
| SCHEMBL5604596 | 0.81 | MAPT (0.40) | ALDH1A1TSHRKDM4EKMT2ATP53 | |
| SCHEMBL6606368 | 0.81 | ALDH1A1 (0.58) | ALDH1A1TSHRKDM4EKMT2AALOX15 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1303508-A1 | SUBSTITUTED 1-(4-AMINOPHENYL)INDOLES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS | Boehringer Ingelheim Pharmaceuticals, Inc. (US) | 2003-04-23 | — | — | EP | disclosed |
| US-6353007-B1 | ANTIINFLAMMATORY AGENTS AND INHIBITORS OF CELLULAR POLIFERATION | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. | 2002-03-05 | — | — | US | disclosed |
| WO-2002006273-A1 | SUBSTITUTED 1-(4-AMINOPHENYL)INDOLES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2002-01-24 | — | — | WO | disclosed |