Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.53 |
| ▸ | ACHE | P22303 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | PDE4A | P27815 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.53 |
| ▸ | DRD3 | P35462 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL10550674 | 0.88 | KDM4E (0.60) | KDM4ECYP1A2CYP2D6CYP3A4LMNA | |
| SCHEMBL10547276 | 0.86 | HRH3 (0.58) | KDM4ECYP1A2CYP2D6CYP3A4LMNA | |
| Hydrochloric Acid SCHEMBL10549609 | 0.86 | NPSR1 (0.53) | KDM4ECYP1A2CYP2D6CYP3A4LMNA | |
| SCHEMBL10548938 | 0.85 | KDM4E (0.47) | KDM4ECYP1A2CYP2D6CYP3A4LMNA | |
| Hydrochloric Acid SCHEMBL10549750 | 0.85 | KDM4E (0.57) | KDM4ECYP1A2CYP2D6CYP3A4LMNA | |
| SCHEMBL10548971 | 0.85 | KDM4E (0.52) | KDM4ECYP1A2CYP2D6CYP3A4LMNA | |
| SCHEMBL10549945 | 0.85 | KDM4E (0.49) | KDM4ECYP1A2CYP2D6CYP3A4LMNA | |
| SCHEMBL10550727 | 0.78 | ALDH1A1 (0.54) | KDM4ECYP1A2CYP2D6CYP3A4LMNA | |
| Hydrochloric Acid SCHEMBL11032767 | 0.78 | KDM4E (0.66) | KDM4ECYP1A2CYP2D6CYP3A4LMNA | |
| Oxalic Acid SCHEMBL10549366 | 0.76 | KDM4E (0.52) | KDM4ECYP1A2CYP2D6CYP3A4LMNA |
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-4829067-A | INHIBITORS OF REFLECTIVE CONTRACTION OF BLADDER | TANABE SEIYAKU CO., LTD. (JP) | 1989-05-09 | — | — | US | disclosed |
| EP-0270342-A2 | A benzo-furan (or -thiophene) derivative and processes for preparing the same | Tanabe Seiyaku Co., Ltd. (JP) | 1988-06-08 | — | — | EP | disclosed |