Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 7/20 | 0.72 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.72 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.72 |
| ▸ | HRH4 | Q9H3N8 | 5/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4054378 | 0.75 | CYP1A2 (0.62) | CYP1A2CYP2C19ALOX15HRH4ALDH1A1 | |
| SCHEMBL2387088 | 0.75 | HRH4 (0.61) | CYP1A2CYP2C19ALOX15HRH4ALDH1A1 | |
| Hydrochloric Acid SCHEMBL11786310 | 0.74 | HRH4 (0.72) | CYP1A2CYP2C19ALOX15HRH4ALDH1A1 | |
| Hydrochloric Acid SCHEMBL11785742 | 0.73 | HRH4 (0.97) | CYP1A2CYP2C19ALOX15HRH4ALDH1A1 | |
| SCHEMBL4066313 | 0.73 | HRH4 (0.61) | CYP1A2CYP2C19ALOX15HRH4ALDH1A1 | |
| SCHEMBL24319168 | 0.73 | HRH4 (0.65) | CYP1A2CYP2C19ALOX15HRH4ALDH1A1 | |
| SCHEMBL4063713 | 0.72 | CYP1A2 (0.62) | CYP1A2CYP2C19ALOX15HRH4ALDH1A1 | |
| SCHEMBL1265477 | 0.72 | CDC7 (0.56) | CYP1A2CYP2C19ALOX15KDM4EMAPT | |
| SCHEMBL1774811 | 0.72 | CYP1A2 (0.57) | CYP1A2CYP2C19ALOX15HRH4ALDH1A1 | |
| SCHEMBL2385543 | 0.71 | HRH4 (0.63) | CYP1A2CYP2C19ALOX15HRH4ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009035671-A1 | SUBSTITUTED NITROGEN-CONTAINING HETEROARYL DERIVATIVES USEFUL AS MODULATORS OF THE HISTAMINE H4 RECEPTOR | JANSSEN PHARMACEUTICA N.V. (BE) | 2009-03-19 | — | — | WO | claimed |
| WO-2009035671-A1 | SUBSTITUTED NITROGEN-CONTAINING HETEROARYL DERIVATIVES USEFUL AS MODULATORS OF THE HISTAMINE H4 RECEPTOR | JANSSEN PHARMACEUTICA N.V. (BE) | 2009-03-19 | — | — | WO | disclosed |