Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.44 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.44 |
| ▸ | CDK2 | P24941 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6151064 | 0.91 | MEN1 (0.46) | ALDH1A1PKMMEN1KMT2ACCNE2 | |
| SCHEMBL22553711 | 0.85 | SIGMAR1 (0.50) | ALDH1A1PKMMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL2390775 | 0.76 | MEN1 (0.68) | ALDH1A1MEN1KMT2ASMN1; SMN2RAB9A | |
| SCHEMBL26100694 | 0.75 | MCHR1 (0.59) | ALDH1A1MEN1KMT2ARAB9ANPC1 | |
| SCHEMBL6142919 | 0.74 | GRM3 (0.44) | ALDH1A1MEN1KMT2ASMN1; SMN2RAB9A | |
| SCHEMBL17182961 | 0.74 | CXCR4 (0.54) | ALDH1A1PKMMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL15718995 | 0.74 | CXCR4 (0.54) | ALDH1A1PKMMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL15718994 | 0.74 | CXCR4 (0.54) | ALDH1A1PKMMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL24515858 | 0.73 | ALDH1A1 (0.45) | ALDH1A1PKMSMN1; SMN2RAB9ANPC1 | |
| SCHEMBL28912432 | 0.72 | KMT2A (0.46) | ALDH1A1MEN1KMT2ASMN1; SMN2RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1021186-B1 | PURINE INHIBITORS OF CYCLIN DEPENDENT KINASE 2 AND IkappaB-alpha | CV THERAPEUTICS INC (US) | 2005-06-29 | — | — | EP | disclosed |