Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7971191 | 0.80 | ALDH1A1 (0.47) | ALDH1A1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL4386655 | 0.78 | KDM4E (0.42) | ALDH1A1 | |
| SCHEMBL7961066 | 0.77 | MAPT (0.55) | ALDH1A1MAPK1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL9865147 | 0.77 | MTNR1A (0.41) | ALDH1A1NPC1RAB9ACASP3SMN1; SMN2 | |
| SCHEMBL9867497 | 0.77 | KMT2A (0.38) | ALDH1A1NPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL28061468 | 0.77 | CYP2C19 (0.51) | ALDH1A1CYP1A2CYP2D6CYP2C19CYP2C9 | |
| Oxalic Acid SCHEMBL7988233 | 0.77 | HRH3 (0.41) | ALDH1A1CYP1A2CYP2C9RAB9AMAOB | |
| SCHEMBL4379711 | 0.76 | HRH3 (0.43) | ALDH1A1NPC1RAB9AMAOBSMN1; SMN2 | |
| Oxalic Acid SCHEMBL7994745 | 0.76 | GAA (0.46) | ALDH1A1MEN1KMT2ALMNAHTT | |
| SCHEMBL1753940 | 0.74 | KCNH2 (0.50) | ALDH1A1NPC1RAB9AMAOAMAOB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0760811-B1 | IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 MODULATORS | INST NAT SANTE RECH MED (FR) | 2009-11-18 | — | — | EP | disclosed |