Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL19782674 | 0.90 | KMT2A (0.33) | ALDH1A1 | |
| SCHEMBL21395713 | 0.76 | MAPT (0.39) | MAPTCYP3A4ALDH1A1TP53TSHR | |
| SCHEMBL21395891 | 0.74 | CYP3A4 (0.37) | MAPTCYP3A4ALDH1A1TP53TSHR | |
| SCHEMBL19783802 | 0.73 | CYP3A4 (0.36) | MAPTCYP3A4ALDH1A1TP53HSD17B10 | |
| SCHEMBL19783779 | 0.69 | KMT2A (0.31) | — | |
| SCHEMBL30189901 | 0.67 | CYP3A4 (0.39) | MAPTCYP3A4ALDH1A1TP53TSHR | |
| SCHEMBL19783135 | 0.67 | CYP3A4 (0.39) | MAPTCYP3A4ALDH1A1TP53TSHR | |
| SCHEMBL19783795 | 0.66 | KMT2A (0.33) | ALDH1A1 | |
| SCHEMBL30189793 | 0.66 | KMT2A (0.33) | ALDH1A1 | |
| SCHEMBL21379620 | 0.66 | KMT2A (0.34) | MAPTALDH1A1 |
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-2018013774-A1 | BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-01-18 | — | — | WO | disclosed |