Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.43 |
| ▸ | KMO | O15229 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.41 |
| ▸ | OXTR | P30559 | 1/20 | 0.41 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.41 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.40 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7946521 | 0.96 | KMO (0.46) | CYP2C9KMOGAAMKNK1MKNK2 | |
| SCHEMBL2157288 | 0.89 | MKNK1 (0.46) | CYP2C9GAAAVPR2OXTRAVPR1A | |
| SCHEMBL7946664 | 0.89 | CYP11B2 (0.43) | CYP2C9AVPR2OXTRAVPR1ACYP11B2 | |
| Hydrochloric Acid SCHEMBL10742608 | 0.88 | CYP2C9 (0.39) | CYP2C9GAAAVPR2OXTRAVPR1A | |
| SCHEMBL7954905 | 0.86 | NR4A2 (0.46) | CYP11B2CYP11B1ALDH1A1MEN1KMT2A | |
| SCHEMBL10742663 | 0.86 | MKNK1 (0.45) | CYP2C9GAAMKNK1MKNK2CYP11B2 | |
| SCHEMBL7953665 | 0.85 | MKNK1 (0.47) | MKNK1MKNK2CYP11B2KMT2A | |
| Hydrochloric Acid SCHEMBL10737389 | 0.84 | CYP11B2 (0.41) | CYP2C9KMOMKNK1MKNK2CYP11B2 | |
| SCHEMBL10737507 | 0.82 | CYP11B2 (0.47) | MKNK1MKNK2CYP11B2CYP11B1CYP1A2 | |
| SCHEMBL7954951 | 0.81 | HDAC3 (0.38) | CYP2C9GAAAVPR2OXTRAVPR1A |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| US-4684658-A | Anti-thrombotic ortho-condensed pyrrole derivatives, compositions, and method of use therefor | RHONE-POULENC SANTE (FR) | 1987-08-04 | — | — | US | disclosed |