Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.53 |
| ▸ | NAAA | Q02083 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.40 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | FAP | Q12884 | 2/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | PREP | P48147 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.36 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | ACACA | Q13085 | 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 | |
|---|---|---|---|---|
| SCHEMBL27879381 | 0.81 | EPHX1 (0.53) | EPHX1NAAAHTTCYP2C19EPHX2 | |
| SCHEMBL1418653 | 0.81 | EPHX1 (0.52) | EPHX1NAAAHTTCYP2C19EPHX2 | |
| SCHEMBL14752276 | 0.81 | EPHX1 (0.52) | EPHX1NAAAHTTCYP2C19EPHX2 | |
| SCHEMBL11186544 | 0.80 | CYP2C19 (0.52) | EPHX1NAAAHTTCYP2C19EPHX2 | |
| SCHEMBL5283279 | 0.80 | EPHX1 (0.52) | EPHX1NAAAHTTCYP2C19EPHX2 | |
| Hydrochloric Acid SCHEMBL1705693 | 0.79 | NAAA (0.50) | EPHX1NAAAHTTCYP2C19EPHX2 | |
| SCHEMBL5505990 | 0.79 | EPHX1 (0.46) | EPHX1NAAAHTTCYP2C19EPHX2 | |
| SCHEMBL7636739 | 0.79 | EPHX1 (0.53) | EPHX1NAAAHTTCYP2C19EPHX2 | |
| SCHEMBL5677254 | 0.79 | NAAA (0.50) | EPHX1NAAAHTTCYP2C19EPHX2 | |
| SCHEMBL23813857 | 0.78 | EPHX1 (0.46) | EPHX1NAAAHTTCYP2C19EPHX2 |
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-6169201-B1 | AMIDO CARBONYLATION UTILIZING CARBON MONOXIDE, NITRILE, AND AN ALDEHYDE IN THE PRESENCE OF A METAL CATALYST | DEGUSSA-HUELS AG (DE) | 2001-01-02 | — | — | US | disclosed |