Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 3/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL23008847 | 0.77 | CYP3A4 (0.47) | TYRCYP3A4HTTCYP2D6CYP2C9 | |
| SCHEMBL29263435 | 0.76 | TYR (0.61) | TYRCYP3A4TSHRMAPTTP53 | |
| SCHEMBL9339634 | 0.74 | TYR (0.74) | TYRCYP3A4TSHRMAPTTP53 | |
| SCHEMBL5377189 | 0.72 | TYR (0.56) | TYRCYP3A4TSHRMAPTTP53 | |
| Rucinol SCHEMBL68792 | 0.72 | TYR (1.00) | TYRCYP3A4TSHRMAPTTP53 | |
| Rucinol SCHEMBL29400052 | 0.72 | TYR (1.00) | TYRCYP3A4TSHRMAPTTP53 | |
| SCHEMBL10921380 | 0.71 | TYR (0.65) | TYRCYP3A4TSHRMAPTTP53 | |
| SCHEMBL31553269 | 0.71 | TYR (0.69) | TYRCYP3A4TSHRMAPTTP53 | |
| SCHEMBL4563615 | 0.71 | TYR (0.69) | TYRCYP3A4TSHRMAPTTP53 | |
| SCHEMBL19453933 | 0.71 | TYR (0.69) | TYRCYP3A4TSHRMAPTTP53 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021029632-A1 | FUSED RING HETEROARYL COMPOUNDS AS RIPK1 INHIBITORS | BISICHEM CO., LTD. (KR) | 2021-02-18 | — | — | WO | disclosed |