Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 2/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | MMP13 | P45452 | 2/20 | 0.44 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP3 | P08254 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28641212 | 0.80 | ALDH1A1 (0.62) | ALDH1A1GAAMAPTKMT2AMMP13 | |
| SCHEMBL7924997 | 0.79 | LMNA (0.52) | ALDH1A1MAPTCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL29118794 | 0.79 | APP (0.48) | ALDH1A1MAPTCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL7931631 | 0.78 | ALDH1A1 (0.59) | ALDH1A1GAAMAPTCYP1A2CYP3A4 | |
| SCHEMBL28440362 | 0.77 | CA12 (0.49) | ALDH1A1GAAHPGDKMT2AACHE | |
| SCHEMBL10825960 | 0.77 | ALDH1A1 (0.59) | ALDH1A1GAAMAPTCYP1A2CYP3A4 | |
| SCHEMBL6424729 | 0.76 | MMP13 (0.50) | ALDH1A1GAAKMT2ACA12CA1 | |
| SCHEMBL10525794 | 0.75 | ACHE (0.71) | ALDH1A1GAAMAPTHPGDKMT2A | |
| SCHEMBL10420685 | 0.74 | MMP13 (0.58) | ALDH1A1GAAMAPTKMT2AMMP13 | |
| SCHEMBL7935192 | 0.73 | PKM (0.57) | ALDH1A1GAAMAPTCYP1A2CYP3A4 |
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-6242478-B1 | ANTICARCINOGENIC AGENTS; REPLICATION INHIBITORS OF HUMAN LYMPHADENOPATHY ASSOCIATED VIRUS(HIV) | WAKE FOREST UNIVERSITY | 2001-06-05 | — | — | US | disclosed |