Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.41 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.41 |
| ▸ | IMPDH2 | P12268 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.37 |
| ▸ | CDK4 | P11802 | 1/20 | 0.35 |
| ▸ | CCND1 | P24385 | 1/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.35 |
| ▸ | CCR4 | P51679 | 1/20 | 0.34 |
| ▸ | MAPK10 | P53779 | 6/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11372655 | 0.86 | MAPK10 (0.43) | KDM4EHTTALDH1A1NCOA1NCOA3 | |
| SCHEMBL29871387 | 0.76 | CYP3A4 (0.47) | KDM4EALDH1A1LMNACYP3A4 | |
| SCHEMBL2852558 | 0.76 | CYP3A4 (0.47) | KDM4EALDH1A1LMNACYP3A4 | |
| SCHEMBL9980542 | 0.71 | EGFR (0.37) | ALDH1A1 | |
| SCHEMBL2722669 | 0.71 | ALDH1A1 (0.46) | KDM4EALDH1A1 | |
| SCHEMBL445595 | 0.71 | IMPDH2 (0.58) | KDM4EHTTALDH1A1NCOA1NCOA3 | |
| SCHEMBL30929170 | 0.70 | EGFR (0.35) | ALDH1A1 | |
| SCHEMBL3745133 | 0.70 | EGFR (0.35) | ALDH1A1 | |
| SCHEMBL28874626 | 0.70 | CYP1A2 (0.43) | KDM4EALDH1A1LMNACYP1A2 | |
| SCHEMBL29966792 | 0.70 | CYP1A2 (0.43) | KDM4EALDH1A1LMNACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1478363-B1 | FUSED AZABICYCLIC COMPOUNDS THAT INHIBIT VANILLOID RECEPTOR SUBTYPE 1 (VR1) RECEPTOR | ABBOTT LAB (US) | 2009-01-14 | — | — | EP | disclosed |
| EP-1660455-B1 | FUSED AZABICYCLIC COMPOUNDS THAT INHIBIT VANILLOID RECEPTOR SUBTYPE 1 (VR1) RECEPTOR | ABBOTT LAB (US) | 2008-10-15 | — | — | EP | disclosed |