Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.32 |
| ▸ | NQO2 | P16083 | 3/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | CA9 | Q16790 | 2/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL27743867 | 0.85 | MAPT (0.38) | ACHEMAPTCYP3A4ALDH1A1CA9 | |
| SCHEMBL30833916 | 0.81 | ACHE (0.52) | ACHEMAPTCYP3A4ALDH1A1 | |
| SCHEMBL15183446 | 0.81 | CYP3A4 (0.38) | ACHEMAPTCYP3A4NQO2TAAR1 | |
| SCHEMBL15183455 | 0.79 | ACHE (0.50) | ACHEMAPTCYP3A4NQO2ALDH1A1 | |
| SCHEMBL10051169 | 0.79 | NQO2 (0.44) | CYP3A4NQO2ALDH1A1CA9CYP19A1 | |
| SCHEMBL30412068 | 0.77 | FFAR4 (0.34) | ACHEMAPTCYP3A4NQO2ALDH1A1 | |
| SCHEMBL13494625 | 0.77 | MAP3K14 (0.44) | ACHEMAPTALDH1A1GAANPSR1 | |
| SCHEMBL19468429 | 0.77 | NQO2 (0.44) | ACHEMAPTNQO2ALDH1A1POLB | |
| SCHEMBL26133106 | 0.77 | FFAR4 (0.34) | ACHEMAPTCYP3A4NQO2ALDH1A1 | |
| SCHEMBL12715606 | 0.77 | MAPT (0.45) | ACHEMAPTCYP3A4TAAR1ALDH1A1 |
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-2022063106-A1 | INDOLINE COMPOUNDS AND DERIVATIVES AS EGFR INHIBITORS | BEIGENE, LTD. (KY) | 2022-03-31 | — | — | WO | disclosed |