Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | ESRRA | P11474 | 3/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | TYR | P14679 | 2/20 | 0.32 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MIF | P14174 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL1881756 | 0.83 | CA1 (0.38) | ALDH1A1ESRRACYP2C9TYRNR1I2 | |
| SCHEMBL1159633 | 0.82 | CASP1 (0.38) | CYP2C9HTTPOLBSMN1; SMN2 | |
| SCHEMBL179542 | 0.79 | GAA (0.47) | ALDH1A1HTTHSD17B10GAACA2 | |
| SCHEMBL13439935 | 0.78 | GPR3 (0.44) | CYP2C9LMNAALOX15HSD17B10GAA | |
| SCHEMBL28440086 | 0.78 | ALDH1A1 (0.57) | ALDH1A1ESRRACYP2C9TYRNR1I2 | |
| SCHEMBL11586044 | 0.76 | TDP1 (0.44) | ALDH1A1LMNAATMPOLBSMN1; SMN2 | |
| SCHEMBL19504075 | 0.76 | PDIA6 (0.46) | ALDH1A1HTTHSD17B10GAACYP1A2 | |
| SCHEMBL8225767 | 0.74 | NQO1 (0.48) | ALDH1A1CYP2C9LMNAALOX15HSD17B10 | |
| SCHEMBL19422370 | 0.74 | ALDH1A1 (0.42) | ALDH1A1LMNAHSD17B10GAANR1H4 | |
| SCHEMBL28829657 | 0.74 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8183311-B2 | Liquid phosphite composition derived from cresols | CHEMTURA CORPORATION (US) | 2012-05-22 | — | — | US | claimed |
| WO-2011014211-A1 | LIQUID PHOSPHITE COMPOSITION DERIVED FROM META-CRESOLS | CHEMTURA CORPORATION (US) | 2011-02-03 | — | — | WO | claimed |
| US-20100076125-A1 | LIQUID PHOSPHITE COMPOSITION DERIVED FROM CRESOLS | CHEMTURA CORPORATION (US) | 2010-03-25 | — | — | US | claimed |
| US-8183311-B2 | Liquid phosphite composition derived from cresols | CHEMTURA CORPORATION (US) | 2012-05-22 | — | — | US | disclosed |
| WO-2011014211-A1 | LIQUID PHOSPHITE COMPOSITION DERIVED FROM META-CRESOLS | CHEMTURA CORPORATION (US) | 2011-02-03 | — | — | WO | disclosed |
| US-20100076125-A1 | LIQUID PHOSPHITE COMPOSITION DERIVED FROM CRESOLS | CHEMTURA CORPORATION (US) | 2010-03-25 | — | — | US | disclosed |