Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.45 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | TYMP | P19971 | 1/20 | 0.38 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4903170 | 0.75 | GSTP1 (0.48) | CYP1A2MAOBALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL2354303 | 0.74 | MEN1 (0.46) | ALDH1A1RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL1003683 | 0.74 | TRPV3 (0.43) | CYP1A2MAOBTRPV3ALDH1A1CYP2C9 | |
| SCHEMBL144673 | 0.73 | CYP1A2 (0.53) | CYP1A2ALDH1A1CYP2C9NOTUMRAB9A | |
| SCHEMBL3558552 | 0.72 | KDM4E (0.66) | KMOCYP1A2CYP3A4CYP2C8TGFBR1 | |
| SCHEMBL3103824 | 0.72 | NOTUM (0.43) | KMOCYP1A2CYP3A4CYP2C8TGFBR1 | |
| SCHEMBL30745584 | 0.72 | NOTUM (0.43) | KMOCYP1A2CYP3A4CYP2C8TGFBR1 | |
| Hydrochloric Acid SCHEMBL28736083 | 0.72 | CYP1A2 (0.52) | CYP1A2ALDH1A1CYP2C9NOTUMRAB9A | |
| SCHEMBL7210200 | 0.72 | MAPK1 (0.50) | CYP1A2CYP3A4CYP2C9CYP2C19RAB9A | |
| SCHEMBL3577075 | 0.71 | C1R (0.44) | CYP1A2CYP3A4TGFBR1TRPV3NOTUM |
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 |
|---|---|---|---|---|---|---|---|
| EP-1021185-A4 | DIDHYDROPYRIMIDINES AND USES THEREOF | SYNAPTIC PHARMA CORP (US) | 2005-09-07 | — | — | EP | disclosed |
| EP-1021185-A1 | DIDHYDROPYRIMIDINES AND USES THEREOF | SYNAPTIC PHARMACEUTICAL CORPORATION (US) | 2000-07-26 | — | — | EP | disclosed |
| WO-1997042956-A1 | DIDHYDROPYRIMIDINES AND USES THEREOF | SYNAPTIC PHARMACEUTICAL CORPORATION (US) | 1997-11-20 | — | — | WO | disclosed |