Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.60 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ADH1B | P00325 | 2/20 | 0.37 |
| ▸ | ADH1C | P00326 | 2/20 | 0.37 |
| ▸ | ADH1A | P07327 | 2/20 | 0.37 |
| ▸ | ADH4 | P08319 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.33 |
| ▸ | ADH7 | P40394 | 1/20 | 0.33 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL8719109 | 0.87 | — | — | |
| SCHEMBL9699116 | 0.84 | ALDH1A1 (0.52) | ALDH1A1HSD17B10THRBATML3MBTL1 | |
| SCHEMBL19575589 | 0.81 | ALDH1A1 (0.48) | ALDH1A1HSD17B10THRBATML3MBTL1 | |
| SCHEMBL19575583 | 0.81 | ALDH1A1 (0.48) | ALDH1A1HSD17B10THRBATML3MBTL1 | |
| N-Methylpiperidine SCHEMBL27991930 | 0.80 | ALDH1A1 (0.60) | ALDH1A1HSD17B10THRBATML3MBTL1 | |
| SCHEMBL13200791 | 0.80 | ALDH1A1 (0.60) | ALDH1A1HSD17B10THRBATML3MBTL1 | |
| Ethane SCHEMBL9776531 | 0.78 | ALDH1A1 (0.86) | ALDH1A1HSD17B10THRBATML3MBTL1 | |
| SCHEMBL22882210 | 0.78 | ALDH1A1 (0.39) | ALDH1A1HSD17B10 | |
| SCHEMBL24771540 | 0.78 | ALDH1A1 (1.00) | ALDH1A1HSD17B10THRBATML3MBTL1 | |
| SCHEMBL24771539 | 0.78 | ALDH1A1 (1.00) | ALDH1A1HSD17B10THRBATML3MBTL1 |
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-2018072602-A1 | THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF | GENENTECH, INC. (US) | 2018-04-26 | — | — | WO | disclosed |