Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 9/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.58 |
| ▸ | USP2 | O75604 | 2/20 | 0.58 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.58 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.58 |
| ▸ | GRM5 | P41594 | 2/20 | 0.58 |
| ▸ | DPP4 | P27487 | 2/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.57 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | GLA | P06280 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL604430 | 0.81 | HRH4 (0.76) | HRH4HTR1AADRA2AADRA2CHTR1D | |
| Hydrochloric Acid SCHEMBL11785742 | 0.80 | HRH4 (0.97) | HRH4CYP1A2ALDH1A1DPP4HSD17B10 | |
| SCHEMBL4061028 | 0.78 | HRH4 (0.67) | HRH4CYP1A2ALDH1A1DPP4HSD17B10 | |
| SCHEMBL2384302 | 0.77 | HRH4 (0.69) | HRH4CYP1A2ALDH1A1CYP3A4USP2 | |
| SCHEMBL28302301 | 0.75 | LRRK2 (0.62) | CYP1A2CYP3A4LRRK2GRM5DPP4 | |
| SCHEMBL10268958 | 0.74 | HRH4 (0.55) | HRH4CYP1A2ALDH1A1CYP3A4USP2 | |
| SCHEMBL12331397 | 0.74 | GRM5 (0.62) | CYP1A2ALDH1A1CYP3A4USP2CLK4 | |
| SCHEMBL9792862 | 0.72 | GRM5 (0.64) | CYP1A2ALDH1A1CYP3A4USP2CLK4 | |
| Hydrochloric Acid SCHEMBL11786310 | 0.72 | HRH4 (0.72) | HRH4CYP1A2ALDH1A1MEN1KMT2A | |
| SCHEMBL9792981 | 0.71 | GRM5 (0.62) | CYP1A2ALDH1A1CYP3A4USP2CLK4 |
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 1 patent. 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 |