Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | LDHA | P00338 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | BMP1 | P13497 | 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 | |
|---|---|---|---|---|
| SCHEMBL7180787 | 0.84 | CYP2C19 (0.41) | CYP2C19KDM4EMEN1KMT2AHPGD | |
| SCHEMBL7187920 | 0.80 | CYP2C19 (0.38) | CYP2C19KDM4EMEN1KMT2AATM | |
| SCHEMBL1699372 | 0.75 | HPGD (0.52) | MEN1KMT2AHPGDHTTALDH1A1 | |
| SCHEMBL9714815 | 0.72 | KDM4E (0.37) | CYP2C19KDM4EMEN1KMT2AATM | |
| Hydrochloric Acid SCHEMBL5138936 | 0.71 | AOC3 (0.41) | MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL8357110 | 0.69 | KDM4E (0.47) | CYP2C19KDM4EMEN1KMT2AATM | |
| SCHEMBL15713200 | 0.69 | SMN1; SMN2 (0.40) | KDM4EHPGDTDP1MAPTALDH1A1 | |
| SCHEMBL7274049 | 0.69 | AOC3 (0.36) | CYP2C19KDM4EMEN1KMT2AMAPT | |
| Hydrochloric Acid SCHEMBL7273717 | 0.69 | TAAR1 (0.46) | KDM4EMEN1KMT2AATMTAAR1 | |
| SCHEMBL28150234 | 0.69 | KDM4E (0.49) | CYP2C19KDM4EMEN1KMT2AHTT |
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 |
|---|---|---|---|---|---|---|---|
| US-5936120-A | FOR TREATING HUMAN IMMMUNODEFICIENCY VIRUS INFECTION IN MAMMALS | UNIVERSITY OF NEW MEXICO (US) | 1999-08-10 | — | — | US | disclosed |
| US-5780675-A | NONCYTOTOXIC; SAPONIFICATION, CYCLIZATION, REDUCTION, REHYDRATION; CATALYTIC HYDROGENOLYSIS | THE UNIVERSITY OF NEW MEXICO (US) | 1998-07-14 | — | — | US | disclosed |