Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6427011 | 0.87 | DHFR (0.43) | DHFRKMT2AALDH1A1HPGDHSD17B10 | |
| SCHEMBL8566937 | 0.80 | MTR (0.44) | DHFRPOLBMAPTKMT2AATM | |
| SCHEMBL8567466 | 0.74 | MTR (0.41) | DHFRPOLBMAPTKMT2AATM | |
| SCHEMBL8562117 | 0.68 | MTR (0.44) | DHFR | |
| SCHEMBL7660756 | 0.66 | P2RX3 (0.47) | DHFRPOLBMAPTKMT2AATM | |
| SCHEMBL9001771 | 0.66 | ATIC (0.41) | — | |
| SCHEMBL27580519 | 0.66 | ALDH1A1 (0.48) | MAPTKMT2AALDH1A1 | |
| SCHEMBL9341089 | 0.64 | CYP2D6 (0.53) | DHFRPOLBMAPTKMT2AATM | |
| SCHEMBL9338914 | 0.64 | CYP2D6 (0.56) | DHFRPOLBMAPTKMT2AATM | |
| SCHEMBL8997177 | 0.64 | NOS1 (0.39) | DHFRMAPTKMT2AALDH1A1NOS1 |
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-6420370-B1 | ANTITUMOR, ANTIBIOTIC, ANTIMALARIAL, ANTIFUNGAL OR ANTIPROTOZOAL AGENTS, OR AS SYNERGISTIC AGENTS ENZYME INHIBITORS | DUQUESNE UNIVERSITY OF THE HOLY GHOST | 2002-07-16 | — | — | US | disclosed |