Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 9/20 | 0.69 |
| ▸ | MAOA | P21397 | 6/20 | 0.69 |
| ▸ | LCK | P06239 | 1/20 | 0.60 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.57 |
| ▸ | CDK1 | P06493 | 1/20 | 0.57 |
| ▸ | CDK4 | P11802 | 1/20 | 0.57 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.57 |
| ▸ | CCND1 | P24385 | 1/20 | 0.57 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.57 |
| ▸ | BCHE | P06276 | 3/20 | 0.57 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.57 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | TLR4 | O00206 | 1/20 | 0.54 |
| ▸ | TLR2 | O60603 | 1/20 | 0.54 |
| ▸ | NR4A2 | P43354 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8674540 | 0.95 | MAOB (0.71) | MAOBMAOALCKCCNB2CDK1 | |
| SCHEMBL6987856 | 0.90 | MAOB (0.56) | MAOBMAOALCKCCNB2CDK1 | |
| SCHEMBL6993494 | 0.90 | MAOB (0.59) | MAOBMAOALCKCCNB2CDK1 | |
| SCHEMBL7817239 | 0.88 | MAOB (0.60) | MAOBMAOALCKCCNB2CDK1 | |
| SCHEMBL7813380 | 0.88 | MAOB (0.63) | MAOBMAOALCKBCHECYP4F2 | |
| SCHEMBL6987590 | 0.84 | MAOB (0.54) | MAOBMAOALCKCCNB2CDK1 | |
| SCHEMBL13859154 | 0.83 | MAOB (0.64) | MAOBMAOALCKCCNB2CDK1 | |
| SCHEMBL1009475 | 0.83 | MAOB (0.68) | MAOBMAOALCKCCNB2CDK1 | |
| SCHEMBL5620883 | 0.81 | MAOB (0.54) | MAOBMAOALCKCCNB2CDK1 | |
| SCHEMBL9434797 | 0.81 | BCHE (0.58) | MAOBMAOALCKCCNB2CDK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5763469-A | Substituted cyclic ureas and derivatives thereof useful as retroviral protease inhibitors | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-06-09 | — | — | US | disclosed |