Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9313613 | 0.82 | SELP (0.35) | — | |
| SCHEMBL9312656 | 0.75 | MAPT (0.48) | BACE1PTGS2CYP3A4 | |
| SCHEMBL9313225 | 0.73 | MEN1 (0.31) | — | |
| SCHEMBL9314494 | 0.70 | ACHE (0.42) | HSP90AB1ACHELTA4HBACE1CTBP2 | |
| SCHEMBL9314760 | 0.67 | — | — | |
| SCHEMBL9312668 | 0.64 | ESR1 (0.33) | PTGS2CYP3A4 | |
| SCHEMBL28721957 | 0.62 | HSP90AB1 (0.58) | HSP90AB1ACHELTA4HBACE1PTGS2 | |
| SCHEMBL9313582 | 0.62 | IAPP (0.39) | — | |
| SCHEMBL23588060 | 0.61 | IDO1 (0.33) | CTBP2CYP3A4 | |
| SCHEMBL8965489 | 0.61 | ACHE (0.48) | HSP90AB1ACHELTA4HBACE1PTGS2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5366996-A | Administering hydroxamic acids | ELFORD HOWARD L (US) | 1994-11-22 | — | — | US | disclosed |
| US-5183828-A | Ribonucleotide reductase inhibitor and free radical scavenger | RIET BARTHOLOMEUS VAN T (US) | 1993-02-02 | — | — | US | disclosed |
| US-4942253-A | INHIBITORS OF RIBONUCLEOTIDE REDUCTASE, ANTITUMOR AGENTS, LEUKEMIA, FREE RADICAL SCAVENGERS | RIET BARTHOLOMEUS VAN T (US) | 1990-07-17 | — | — | US | disclosed |
| US-4623659-A | RIBONUCLEOTIDE REDUCTASE INHIBITORS | RIET BARTHOLOMEUS VAN T (US) | 1986-11-18 | — | — | US | disclosed |