Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 2/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | NOS3 | P29474 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.40 |
| ▸ | USP2 | O75604 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 2/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28212072 | 0.84 | CYP1A2 (0.45) | CYP1A2CYP2C9USP2ALDH1A1CYP2C19 | |
| SCHEMBL4763970 | 0.79 | FGFR1 (0.40) | CTSLCTSSMAOAMAOBTAAR1 | |
| SCHEMBL4723966 | 0.78 | CYP1A2 (0.43) | CYP1A2CYP2C9USP2ALDH1A1CYP2C19 | |
| SCHEMBL28212561 | 0.76 | CYP1A2 (0.47) | CYP1A2CYP2C9USP2ALDH1A1CYP2C19 | |
| SCHEMBL2173797 | 0.70 | MKNK2 (0.40) | CYP1A2CYP2C9USP2ALDH1A1CYP2C19 | |
| SCHEMBL25818492 | 0.70 | MKNK2 (0.40) | CYP1A2CYP2C9USP2ALDH1A1CYP2C19 | |
| SCHEMBL13195335 | 0.70 | MKNK2 (0.40) | CYP1A2 | |
| SCHEMBL15833488 | 0.68 | MAPK13 (0.39) | NOS1NOS3ALDH1A1HDAC6 | |
| SCHEMBL15833690 | 0.68 | MTNR1A (0.36) | ALDH1A1TAAR1 | |
| SCHEMBL28309924 | 0.67 | KLKB1 (0.38) | CYP1A2CYP2C9USP2ALDH1A1CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1957488-A1 | 3-AMINO-2-ARYLPROPYL AZAINDOLES AND USES THEREOF | F.HOFFMANN-LA ROCHE AG (CH) | 2008-08-20 | — | — | EP | disclosed |
| WO-2007062998-A1 | 3-AMINO-2-ARYLPROPYL AZAINDOLES AND USES THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2007-06-07 | — | — | WO | disclosed |