Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.57 |
| ▸ | TP53 | P04637 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | HTR1B | P28222 | 1/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.47 |
| ▸ | PNMT | P11086 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | DHFR | P00374 | 2/20 | 0.45 |
| ▸ | DPP4 | P27487 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1290535 | 0.98 | KDM4E (0.61) | KDM4ETP53ALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL14830658 | 0.90 | ALDH1A1 (0.57) | KDM4ETP53ALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL7968991 | 0.87 | TDP1 (0.54) | KDM4ETP53ALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL1032880 | 0.83 | KDM4E (0.68) | KDM4ETP53ALDH1A1SMN1; SMN2CYP1A2 | |
| Hydrochloric Acid SCHEMBL6492504 | 0.82 | KDM4E (0.72) | KDM4ETP53ALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL13744588 | 0.81 | KDM4E (0.53) | KDM4ETP53ALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL10359841 | 0.80 | TSHR (0.68) | KDM4ETP53ALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL15473216 | 0.80 | ALDH1A1 (0.54) | KDM4ETP53ALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL28043167 | 0.80 | ALDH1A1 (0.54) | KDM4ETP53ALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL2206657 | 0.80 | ALDH1A1 (0.54) | KDM4ETP53ALDH1A1SMN1; SMN2CYP1A2 |
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-2012045729-A1 | IMIDAZO [1, 2 -A] PYRIDINE AND PYRAZOLO [1, 5 -A] PYRIDINE DERIVATIVES AS TRPV1 ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2012-04-12 | — | — | WO | disclosed |