Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 6/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28102452 | 1.00 | DGAT1 (0.46) | DGAT1ALDH1A1LMNAMAPTCYP2C9 | |
| SCHEMBL10197496 | 0.86 | DGAT1 (0.47) | DGAT1ALDH1A1LMNAMAPTCYP2C9 | |
| SCHEMBL382898 | 0.86 | ESR2 (0.56) | DGAT1ALDH1A1LMNAMAPTCYP2C9 | |
| SCHEMBL382897 | 0.86 | ESR2 (0.56) | DGAT1ALDH1A1LMNAMAPTCYP2C9 | |
| SCHEMBL17327330 | 0.86 | ESR2 (0.56) | DGAT1ALDH1A1LMNAMAPTCYP2C9 | |
| SCHEMBL4673308 | 0.85 | DGAT1 (0.46) | DGAT1ALDH1A1LMNAMAPTCYP2C9 | |
| SCHEMBL17327303 | 0.85 | DGAT1 (0.51) | DGAT1ALDH1A1LMNAMAPTKMT2A | |
| SCHEMBL1399745 | 0.85 | DGAT1 (0.51) | DGAT1ALDH1A1LMNAMAPTCYP2C9 | |
| SCHEMBL18763690 | 0.85 | DGAT1 (0.51) | DGAT1ALDH1A1LMNAMAPTKMT2A | |
| SCHEMBL28817040 | 0.85 | IDO1 (0.56) | DGAT1MAPTIDO1SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104496795-B | A kind of preparation method of DGAT-1 inhibitor intermediate | 重庆博腾制药科技股份有限公司 | 2016-09-14 | — | — | CN | disclosed |