Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| Diethanolamine SCHEMBL2405576 | 0.89 | TGFBR1 (0.38) | TGFBR1MEN1KMT2APOLBALDH1A1 | |
| Diethanolamine SCHEMBL7729802 | 0.89 | TGFBR1 (0.38) | TGFBR1MEN1KMT2APOLBALDH1A1 | |
| Acetic Acid SCHEMBL27210323 | 0.86 | CYP2C19 (0.39) | CYP2C19MEN1GLAKMT2ACYP1A2 | |
| Acetic Acid SCHEMBL8850209 | 0.86 | CYP2C19 (0.39) | CYP2C19MEN1GLAKMT2ACYP1A2 | |
| Methacrylic Acid SCHEMBL30732488 | 0.84 | PAOX (0.42) | TGFBR1CYP2C19MEN1GLAKMT2A | |
| Acetic Acid SCHEMBL28324458 | 0.84 | CYP2C19 (0.38) | CYP2C19MEN1GLAKMT2ACYP1A2 | |
| Acetic Acid SCHEMBL28660785 | 0.84 | CYP2C19 (0.38) | CYP2C19MEN1GLAKMT2ACYP1A2 | |
| Methacrylic Acid SCHEMBL5514685 | 0.84 | TP53 (0.44) | TGFBR1TSHRALDH1A1ALOX15 | |
| Acetic Acid SCHEMBL7158387 | 0.82 | CYP2C19 (0.42) | CYP2C19MEN1GLAKMT2ACYP1A2 | |
| Bicarbonate SCHEMBL28204460 | 0.81 | CYP2C19 (0.39) | CYP2C19MEN1GLAKMT2ACYP1A2 |
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-104284918-B | urethane type and urea ester type compound and preparation method thereof | 高剑萍 | 2017-03-29 | — | — | CN | claimed |