Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KHK | P50053 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.44 |
| ▸ | RAB9A | P51151 | 7/20 | 0.44 |
| ▸ | NPC1 | O15118 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | TP53 | P04637 | 4/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7701943 | 0.89 | MEN1 (0.45) | SMN1; SMN2RAB9ANPC1ALDH1A1MAPT | |
| SCHEMBL7707161 | 0.87 | EPHX2 (0.51) | KHKSMN1; SMN2RAB9ANPC1ALDH1A1 | |
| SCHEMBL7707803 | 0.85 | ROCK2 (0.48) | KHKSMN1; SMN2RAB9ANPC1ALDH1A1 | |
| SCHEMBL7091715 | 0.85 | MEN1 (0.43) | SMN1; SMN2RAB9ANPC1ALDH1A1MAPT | |
| SCHEMBL7087744 | 0.83 | MEN1 (0.43) | KHKSMN1; SMN2RAB9ANPC1ALDH1A1 | |
| SCHEMBL7137687 | 0.83 | RAB9A (0.52) | KHKSMN1; SMN2RAB9ANPC1ALDH1A1 | |
| SCHEMBL7707120 | 0.82 | SMN1; SMN2 (0.46) | KHKSMN1; SMN2RAB9ANPC1ALDH1A1 | |
| SCHEMBL7707778 | 0.82 | SMN1; SMN2 (0.46) | KHKSMN1; SMN2RAB9ANPC1ALDH1A1 | |
| SCHEMBL7707740 | 0.78 | RAB9A (0.55) | KHKSMN1; SMN2RAB9ANPC1ALDH1A1 | |
| SCHEMBL7701969 | 0.76 | SMN1; SMN2 (0.48) | KHKSMN1; SMN2RAB9ANPC1ALDH1A1 |
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 4 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 | claimed |
| US-6353007-B1 | ANTIINFLAMMATORY AGENTS AND INHIBITORS OF CELLULAR POLIFERATION | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. | 2002-03-05 | — | — | US | claimed |
| WO-2002006273-A1 | SUBSTITUTED 1-(4-AMINOPHENYL)INDOLES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2002-01-24 | — | — | WO | claimed |
| US-6353007-B1 | ANTIINFLAMMATORY AGENTS AND INHIBITORS OF CELLULAR POLIFERATION | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. | 2002-03-05 | — | — | US | disclosed |