Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR2 | O15552 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | FBP1 | P09467 | 1/20 | 0.32 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.32 |
| ▸ | SCN1A | P35498 | 1/20 | 0.32 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.32 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.32 |
| ▸ | HTR7 | P34969 | 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 | |
|---|---|---|---|---|
| SCHEMBL14099264 | 0.77 | SCN1A (0.42) | FFAR2ALDH1A1TSHRNOS1HSD17B10 | |
| SCHEMBL13844015 | 0.72 | FFAR2 (0.35) | FFAR2ALDH1A1TSHRNOS1HSD17B10 | |
| SCHEMBL1903243 | 0.70 | — | — | |
| SCHEMBL11952511 | 0.69 | FFAR2 (0.40) | FFAR2ALDH1A1TSHRNOS1HSD17B10 | |
| SCHEMBL1428355 | 0.69 | FFAR2 (0.43) | FFAR2ALDH1A1TSHRHSD17B10 | |
| SCHEMBL8716232 | 0.69 | FFAR2 (0.42) | FFAR2ALDH1A1TSHRNOS1HSD17B10 | |
| Hydrochloric Acid SCHEMBL17080155 | 0.69 | — | — | |
| SCHEMBL25781210 | 0.68 | ALDH1A1 (0.47) | FFAR2ALDH1A1TSHRNOS1HSD17B10 | |
| SCHEMBL15867718 | 0.67 | ALDH1A1 (0.39) | FFAR2ALDH1A1TSHRNOS1HSD17B10 | |
| SCHEMBL2220312 | 0.67 | — | — |
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-9926282-B2 | Phthalazinones and isoquinolinones as rock inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-03-27 | — | — | US | disclosed |