Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.36 |
| ▸ | MMP7 | P09237 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL199861 | 0.69 | GAA (0.53) | DAOALDH1A1L3MBTL1MAPTCYP2C9 | |
| Benzene SCHEMBL27553763 | 0.69 | GAA (0.53) | DAOALDH1A1L3MBTL1MAPTCYP2C9 | |
| SCHEMBL41618 | 0.69 | GAA (0.53) | DAOALDH1A1L3MBTL1MAPTCYP2C9 | |
| SCHEMBL41619 | 0.69 | GAA (0.53) | DAOALDH1A1L3MBTL1MAPTCYP2C9 | |
| SCHEMBL3381061 | 0.68 | FPR2 (0.51) | ALDH1A1MMP1MMP2MMP3MMP7 | |
| SCHEMBL3972557 | 0.68 | FPR2 (0.51) | ALDH1A1MMP1MMP2MMP3MMP7 | |
| SCHEMBL1679307 | 0.68 | CYP2C9 (0.53) | DAOCES2CES1ALDH1A1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL9474549 | 0.68 | GAA (0.51) | DAOALDH1A1L3MBTL1MAPTCYP2C9 | |
| Hydrochloric Acid SCHEMBL11389456 | 0.68 | GAA (0.51) | DAOALDH1A1L3MBTL1MAPTCYP2C9 | |
| SCHEMBL29412001 | 0.67 | BCL2L1 (0.47) | GAAALOX15 |
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-20140336216-A1 | PHYSIOLOGICAL LIGANDS FOR GPR139 | JANSSEN PHARMACEUTICA NV (BE) | 2014-11-13 | — | — | US | disclosed |