Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.66 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.66 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.66 |
| ▸ | GPR132 | Q9UNW8 | 2/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | MMP13 | P45452 | 2/20 | 0.49 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | ACACB | O00763 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.49 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.49 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL18906035 | 0.85 | NR4A2 (0.69) | CYP19A1CYP11B1CYP11B2GPR132HTT | |
| SCHEMBL6955979 | 0.84 | MAOB (0.68) | CYP19A1CYP11B1CYP11B2GPR132HTT | |
| SCHEMBL23488238 | 0.84 | PARP10 (0.68) | CYP19A1CYP11B1CYP11B2GPR132HTT | |
| SCHEMBL7914601 | 0.84 | CYP19A1 (0.47) | CYP19A1CYP11B1CYP11B2HTTSMN1; SMN2 | |
| SCHEMBL28048524 | 0.83 | MAPK1 (0.64) | CYP19A1CYP11B1CYP11B2GPR132HTT | |
| SCHEMBL1960673 | 0.82 | NR4A1 (0.72) | CYP19A1CYP11B1CYP11B2HTTSMN1; SMN2 | |
| SCHEMBL7256001 | 0.79 | GPR132 (0.61) | CYP19A1CYP11B1CYP11B2GPR132HTT | |
| SCHEMBL14676052 | 0.78 | NAPRT (0.66) | CYP19A1CYP11B1CYP11B2GPR132HTT | |
| SCHEMBL9630106 | 0.77 | ACACB (0.58) | CYP19A1CYP11B1CYP11B2GPR132HTT | |
| SCHEMBL7311175 | 0.76 | MAPK1 (0.65) | GPR132RAB9AMAPK1MEN1KMT2A |
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-6211234-B1 | BENZONITRILE COMPOUNDS WITH ETHER AND SULFIDE GROUPS WITH CARBOXY ACID | RHONE-POULENC RORER LIMITED (GB) | 2001-04-03 | — | — | US | disclosed |
| EP-0728128-B1 | SUBSTITUTED PHENYL COMPOUNDS | RHONE POULENC RORER LTD (GB) | 1998-09-16 | — | — | EP | disclosed |
| EP-0728128-A1 | SUBSTITUTED PHENYL COMPOUNDS | RHONE-POULENC RORER LIMITED (GB) | 1996-08-28 | — | — | EP | disclosed |
| WO-1995013262-A1 | SUBSTITUTED PHENYL COMPOUNDS | RHONE-POULENC RORER LIMITED (GB) | 1995-05-18 | — | — | WO | disclosed |