Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.60 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.54 |
| ▸ | PPARG | P37231 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.46 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8073749 | 1.00 | KMO (0.60) | KMOKLKB1PPARGNPC1RAB9A | |
| SCHEMBL8073751 | 1.00 | KMO (0.60) | KMOKLKB1PPARGNPC1RAB9A | |
| SCHEMBL7403249 | 0.81 | KMO (0.74) | KMOPPARGPPARA | |
| SCHEMBL21610463 | 0.77 | PPARG (0.61) | PPARGNPC1RAB9AEPHX2ALDH1A1 | |
| SCHEMBL3667472 | 0.77 | KMO (1.00) | KMOPPARGCYP1A2PPARA | |
| SCHEMBL727440 | 0.77 | KMO (1.00) | KMOPPARGCYP1A2PPARA | |
| SCHEMBL728320 | 0.77 | KMO (1.00) | KMOPPARGCYP1A2PPARA | |
| SCHEMBL16284888 | 0.74 | NPC1 (0.60) | KMOPPARGNPC1RAB9ACYP1A2 | |
| SCHEMBL3101828 | 0.74 | NPC1 (0.60) | KMOPPARGNPC1RAB9ACYP1A2 | |
| SCHEMBL16284887 | 0.74 | NPC1 (0.60) | KMOPPARGNPC1RAB9ACYP1A2 |
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-6133302-A | KYNURENINE-3-HYDROXYLASE ENZYME INHIBITORY ACTIVITY, AN ENZYME OF THE KYNURENINE (KYN) PATHWAY; COMPOUNDS SUCH AS 5-(3-(3-FLUOROPHENYL)-3-OXO-PROPYL)-1H-TETRAZOLE; FOR TREATMENT OF NEUROPATHOLOGICAL PROCESSES | PHARMACIA & UPJOHN SPA (IT) | 2000-10-17 | — | — | US | disclosed |