Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC1 | P33527 | 10/20 | 0.43 |
| ▸ | ABCG2 | Q9UNQ0 | 7/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7590017 | 0.86 | CYP11B2 (0.44) | ABCC1ABCG2RXFP1ALDH1A1TSHR | |
| SCHEMBL7953706 | 0.85 | ABCC1 (0.43) | ABCC1ABCG2RXFP1ALDH1A1TSHR | |
| SCHEMBL7955650 | 0.75 | ABCC1 (0.42) | ABCC1ABCG2RXFP1ALDH1A1TSHR | |
| SCHEMBL7960169 | 0.75 | ABCC1 (0.42) | ABCC1ABCG2RXFP1ALDH1A1TSHR | |
| SCHEMBL7587234 | 0.73 | ABCC1 (0.44) | ABCC1ABCG2RXFP1ALDH1A1TSHR | |
| SCHEMBL2157173 | 0.73 | ABCC1 (0.37) | ABCC1ABCG2RXFP1ALDH1A1TSHR | |
| SCHEMBL6291378 | 0.71 | RIPK3 (0.44) | KMT2A | |
| SCHEMBL7954850 | 0.71 | ABCC1 (0.43) | ABCC1ABCG2RXFP1ALDH1A1TSHR | |
| SCHEMBL7946431 | 0.71 | ALDH1A1 (0.39) | ABCC1ABCG2RXFP1ALDH1A1KDM4E | |
| SCHEMBL7954831 | 0.71 | ALDH1A1 (0.39) | ABCC1ABCG2RXFP1ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-6194426-B1 | CONTROLLING TUMOR NECROSIS FACTOR | RHONA-POULENC RORER S.A. (FR) | 2001-02-27 | — | — | US | disclosed |
| EP-0833635-A1 | NOVEL USE FOR PYRROLE DERIVATIVES | Aventis Pharma S.A. (FR) | 1998-04-08 | — | — | EP | disclosed |
| WO-1997000073-A1 | NOVEL USE FOR PYRROLE DERIVATIVES | RHONE-POULENC RORER S.A. (FR) | 1997-01-03 | — | — | WO | disclosed |