Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | HTR2C | P28335 | 2/20 | 0.51 |
| ▸ | HTR2B | P41595 | 2/20 | 0.51 |
| ▸ | SYK | P43405 | 1/20 | 0.50 |
| ▸ | BRD4 | O60885 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.48 |
| ▸ | DRD1 | P21728 | 1/20 | 0.48 |
| ▸ | DRD4 | P21917 | 1/20 | 0.48 |
| ▸ | DRD5 | P21918 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7792380 | 0.94 | CYP2D6 (0.53) | CYP2D6TSHRKDM4EALDH1A1TDP1 | |
| SCHEMBL7792140 | 0.94 | CYP2D6 (0.65) | CYP2D6TSHRKDM4EALDH1A1TDP1 | |
| SCHEMBL7796201 | 0.90 | KDM4E (0.54) | CYP2D6TSHRKDM4EALDH1A1BRD4 | |
| SCHEMBL7796485 | 0.90 | TSHR (0.49) | CYP2D6TSHRKDM4EALDH1A1TDP1 | |
| SCHEMBL7791821 | 0.90 | CHEK1 (0.50) | CYP2D6TSHRKDM4EALDH1A1TDP1 | |
| SCHEMBL7796344 | 0.89 | MAPK1 (0.53) | CYP2D6TSHRKDM4EALDH1A1HTR2B | |
| SCHEMBL7792217 | 0.89 | POLB (0.62) | CYP2D6KDM4EALDH1A1TDP1HTR2C | |
| SCHEMBL7795901 | 0.89 | CYP2D6 (0.61) | CYP2D6TSHRKDM4EALDH1A1TDP1 | |
| SCHEMBL7796315 | 0.88 | CHEK1 (0.54) | CYP2D6TSHRKDM4EALDH1A1TDP1 | |
| SCHEMBL7794948 | 0.88 | POLB (0.60) | CYP2D6TSHRKDM4EALDH1A1TDP1 |
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-0906268-B1 | ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS | AVENTIS PHARMA INC (US) | 2001-11-28 | — | — | EP | disclosed |
| US-6004959-A | HYPOTENSIVE, ANTITUMOR, ANTIINFLAMMATORY AND ANTIASTHMATIC AGENTS; ANGIOGENESIS AND ALVEOLAR MACROPHAGE ACTIVATION INHIBITORS | HOECHST MARION ROUSSEL, INC. (US) | 1999-12-21 | — | — | US | disclosed |