Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 3/20 | 0.61 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23665897 | 0.85 | CYP4F2 (0.65) | CYP4F2CYP4A11ALDH1A1GAASMN1; SMN2 | |
| SCHEMBL69660 | 0.82 | CYP4F2 (0.86) | CYP4F2CYP4A11ALDH1A1GAASMN1; SMN2 | |
| SCHEMBL3110101 | 0.80 | CA12 (0.51) | ALDH1A1SMN1; SMN2CA12CA1CA2 | |
| SCHEMBL10585673 | 0.79 | CA12 (0.50) | CA12CA1CA2CA4CA7 | |
| SCHEMBL28008696 | 0.79 | CYP4F2 (0.81) | CYP4F2CYP4A11ALDH1A1GAASMN1; SMN2 | |
| SCHEMBL7509868 | 0.78 | CA12 (0.46) | CYP4F2CYP4A11ALDH1A1CYP2D6CA12 | |
| SCHEMBL13948404 | 0.78 | CYP4F2 (0.73) | CYP4F2CYP4A11ALDH1A1GAASMN1; SMN2 | |
| SCHEMBL12419024 | 0.77 | CA12 (0.55) | ALDH1A1MAPTCA12CA1CA2 | |
| SCHEMBL18455674 | 0.76 | CYP4F2 (0.71) | CYP4F2CYP4A11ALDH1A1GAASMN1; SMN2 | |
| SCHEMBL22098182 | 0.76 | CYP4F2 (1.00) | CYP4F2CYP4A11ALDH1A1GAASMN1; SMN2 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7141694-B2 | Enzymatic resolution of aryl and thio-substituted acids | BRISTOL-MYERS SQUIBB COMPANY (US) | 2006-11-28 | — | — | US | disclosed |
| US-7026143-B2 | Enzymatic resolution of aryl and thio-substituted acids | BRISTOL-MYERS SQUIBB COMPANY (US) | 2006-04-11 | — | — | US | disclosed |
| US-20040077061-A1 | Enzymatic resolution of aryl and thio-substituted acids | ZHU JINGYANG (US) | 2004-04-22 | — | — | US | disclosed |
| US-20040072310-A1 | Enzymatic resolution of aryl and thio-substituted acids | ZHU JINGYANG (US) | 2004-04-15 | — | — | US | disclosed |
| US-6620600-B2 | Monitoring preferential compounds in racemic; obtain enantiomer, incubate with racemic mix, hydrolyze mix, recover preferential compound | BRISTOL-MYERS SQUIBB CO. | 2003-09-16 | — | — | US | disclosed |
| EP-1328655-A2 | ENZYMATIC RESOLUTION OF ARYL- AND THIO-SUBSTITUTED ACIDS | Bristol-Myers Squibb Company (US) | 2003-07-23 | — | — | EP | disclosed |
| US-20020061565-A1 | Monitoring preferential compounds in racemic; obtain enantiomer, incubate with racemic mix, hydrolyze mix, recover preferential compound | BRISTOL-MYERS SQUIBB COMPANY | 2002-05-23 | — | — | US | disclosed |
| WO-2002022849-A2 | ENZYMATIC RESOLUTION OF ARYL- AND THIO-SUBSTITUTED ACIDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2002-03-21 | — | — | WO | disclosed |