Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 2/20 | 0.39 |
| ▸ | PARP1 | P09874 | 6/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 7/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16600346 | 0.90 | KMO (0.51) | KMOPARP1TDP1AKR1B1 | |
| SCHEMBL16600309 | 0.90 | KMO (0.51) | KMOPARP1TDP1AKR1B1 | |
| SCHEMBL21218966 | 0.90 | KMO (0.51) | KMOPARP1TDP1AKR1B1 | |
| SCHEMBL21231297 | 0.90 | KMO (0.51) | KMOPARP1TDP1AKR1B1 | |
| SCHEMBL16614134 | 0.88 | KMO (0.37) | KMOPARP1TDP1AKR1B1MAOA | |
| SCHEMBL20032572 | 0.85 | KMO (0.37) | KMO | |
| SCHEMBL20032576 | 0.78 | KMO (0.40) | KMOAKR1B1 | |
| SCHEMBL20032573 | 0.76 | TDP1 (0.63) | KMOTDP1AKR1B1MAOA | |
| SCHEMBL21231402 | 0.75 | KMO (0.49) | KMOTDP1AKR1B1 | |
| SCHEMBL16614133 | 0.75 | KMO (0.49) | KMOTDP1AKR1B1 |
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-9938252-B2 | Kynurenine-3-monooxygenase inhibitors, pharmaceutical compositions, and methods of use thereof | CHDI FOUNDATION, INC. (US) | 2018-04-10 | — | — | US | disclosed |