Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOS1 | Q07889 | 1/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | TDO2 | P48775 | 2/20 | 0.43 |
| ▸ | PDE2A | O00408 | 1/20 | 0.41 |
| ▸ | HSPB1 | P04792 | 1/20 | 0.41 |
| ▸ | SCN4A | P35499 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.36 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL16649847 | 1.00 | SOS1 (0.46) | SOS1ADRB2IDO1TDO2PDE2A | |
| Hydrochloric Acid SCHEMBL22159069 | 0.98 | IDO1 (0.45) | SOS1ADRB2IDO1TDO2PDE2A | |
| Hydrochloric Acid SCHEMBL22159071 | 0.98 | IDO1 (0.45) | SOS1ADRB2IDO1TDO2PDE2A | |
| SCHEMBL24152555 | 0.89 | ADRB2 (0.54) | ADRB2PDE2AALDH1A1MEN1KMT2A | |
| SCHEMBL157927 | 0.87 | ADRB2 (0.56) | ADRB2IDO1TDO2PDE2AMAOA | |
| SCHEMBL516801 | 0.87 | ADRB2 (0.56) | ADRB2IDO1TDO2PDE2AMAOA | |
| SCHEMBL56723 | 0.87 | ADRB2 (0.56) | ADRB2IDO1TDO2PDE2AMAOA | |
| Hydrochloric Acid SCHEMBL14576625 | 0.84 | ADRB2 (0.54) | ADRB2IDO1TDO2PDE2AMAOA | |
| Bromide SCHEMBL25231048 | 0.84 | ADRB2 (0.54) | ADRB2IDO1TDO2PDE2AMAOA | |
| Hydrochloric Acid SCHEMBL1887841 | 0.84 | ADRB2 (0.54) | ADRB2IDO1TDO2PDE2AMAOA |
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-2009117421-A2 | HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE | KALYPSYS, INC. (US) | 2009-09-24 | — | — | WO | disclosed |