Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.57 |
| ▸ | CES1 | P23141 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 3/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | MITF | O75030 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | AHR | P35869 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | F2 | P00734 | 1/20 | 0.48 |
| ▸ | PLAU | P00749 | 1/20 | 0.48 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.48 |
| ▸ | ELANE | P08246 | 1/20 | 0.48 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Methyl Carbamate SCHEMBL28555184 | 0.94 | POLB (0.60) | CES1POLBKMT2AMEN1TSHR | |
| SCHEMBL254774 | 0.89 | CES1 (0.70) | CES2CES1POLBKMT2AMEN1 | |
| Methyl Carbamate SCHEMBL28103654 | 0.88 | POLB (0.64) | CES2CES1POLBKMT2AMEN1 | |
| Methane SCHEMBL28800504 | 0.88 | CES1 (0.68) | CES2CES1POLBKMT2AMEN1 | |
| SCHEMBL28451508 | 0.87 | CES1 (0.58) | CES2CES1POLBKMT2AMEN1 | |
| Nitrobenzene SCHEMBL28020738 | 0.84 | ALDH1A1 (0.61) | CES2CES1POLBKMT2AMEN1 | |
| Methylamine SCHEMBL29169653 | 0.84 | TSHR (0.60) | CES2CES1POLBKMT2AMEN1 | |
| SCHEMBL11527677 | 0.82 | TSHR (0.63) | CES2CES1POLBKMT2AMEN1 | |
| SCHEMBL254773 | 0.82 | CES1 (0.65) | CES2CES1POLBKMT2AMEN1 | |
| SCHEMBL27866766 | 0.80 | POLB (0.62) | CES1POLBKMT2AMEN1TSHR |
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-112771027-A | Lysophosphatidic acid receptor antagonists and process for their preparation | 武汉朗来科技发展有限公司 | 2021-05-07 | — | — | CN | disclosed |