Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 5/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | GLA | P06280 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 1/20 | 0.60 |
| ▸ | HPGD | P15428 | 1/20 | 0.60 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.60 |
| ▸ | CASP1 | P29466 | 1/20 | 0.60 |
| ▸ | CASP7 | P55210 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.60 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.56 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.56 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 4/20 | 0.54 |
| ▸ | RAB9A | P51151 | 4/20 | 0.54 |
| ▸ | TTR | P02766 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL8711806 | 0.90 | MAOA (0.60) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL10867585 | 0.83 | MAOA (0.63) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL6521976 | 0.83 | MAOA (0.60) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL18242719 | 0.81 | MAOA (0.56) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL21468275 | 0.80 | CYP11B1 (0.51) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL16034359 | 0.80 | TTR (0.61) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL21117503 | 0.80 | MAOA (0.55) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL21129374 | 0.80 | MAOA (0.55) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL2963854 | 0.79 | CYP1A2 (0.60) | MAOAKDM4EALDH1A1GLACYP3A4 | |
| SCHEMBL18242248 | 0.78 | MAOA (0.53) | MAOAKDM4EALDH1A1GLACYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5830902-A | SQUALENE SYNTHASE INHIBITOR | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1998-11-03 | — | — | US | disclosed |
| EP-0812840-A1 | NOVEL QUINUCLIDINE DERIVATIVES HAVING TRICYCLIC FUSED HETERO RING | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1997-12-17 | — | — | EP | disclosed |