Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | POLQ | O75417 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 4/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | RPS27 | P42677 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8891696 | 0.91 | MAPK8 (0.38) | PIK3CDPIK3CBPIK3CAADORA2AADORA1 | |
| SCHEMBL11504985 | 0.89 | AURKA (0.41) | ALDH1A1CYP1A2CYP2C19SMN1; SMN2KDM4E | |
| SCHEMBL10611877 | 0.82 | CYP2D6 (0.43) | ALDH1A1CYP1A2CYP2C19SMN1; SMN2KDM4E | |
| SCHEMBL11506763 | 0.76 | KDM4E (0.31) | ALDH1A1KDM4EMAPK1 | |
| SCHEMBL9468243 | 0.76 | MAPK8 (0.41) | ALDH1A1KDM4EHPGDHSD17B10RPS27 | |
| SCHEMBL11454175 | 0.73 | MAPK8 (0.43) | RPS27MAPK8 | |
| SCHEMBL10611871 | 0.73 | CYP2D6 (0.40) | ALDH1A1CYP1A2CYP2C19SMN1; SMN2KDM4E | |
| SCHEMBL11504964 | 0.72 | MEN1 (0.42) | ALDH1A1CYP1A2CYP2C19CYP3A4ADORA2A | |
| SCHEMBL8891710 | 0.72 | MAPK8 (0.40) | ALDH1A1KDM4EHPGDAURKACYP3A4 | |
| SCHEMBL11504988 | 0.70 | AURKA (0.50) | ALDH1A1CYP1A2CYP2C19SMN1; SMN2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-4276045-A | MONOAZO DISPERSE DYES | BASF AKTIENGESELLSCHAFT (DE) | 1981-06-30 | — | — | US | disclosed |