Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | PGK1 | P00558 | 1/20 | 0.34 |
| ▸ | PGK2 | P07205 | 1/20 | 0.34 |
| ▸ | MITF | O75030 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9855452 | 0.74 | PTPN1 (0.48) | CES2CES1MEN1KMT2ARAB9A | |
| SCHEMBL9855202 | 0.72 | PLOD2 (0.42) | CA12MMP2CES2CES1MEN1 | |
| SCHEMBL9855299 | 0.63 | CES2 (0.41) | CES2CES1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL9855130 | 0.63 | CES2 (0.41) | CES2CES1RAB9ANPC1HTT | |
| Phosphoric Acid SCHEMBL5148554 | 0.62 | LTA4H (0.61) | CES2CES1MEN1KMT2ARAB9A | |
| SCHEMBL31191256 | 0.62 | CES2 (0.64) | CES2CES1MEN1KMT2ARAB9A | |
| SCHEMBL11050791 | 0.61 | CES2 (0.54) | CES2CES1MEN1KMT2ARAB9A | |
| SCHEMBL1486788 | 0.61 | PGK1 (0.59) | CA12MMP2PGK1PGK2 | |
| SCHEMBL777805 | 0.61 | ACP3 (0.57) | CA12MMP2PGK1PGK2 | |
| SCHEMBL779192 | 0.61 | CA12 (0.46) | CA12MMP2SMN1; SMN2PGK1PGK2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5011947-A | Enzyme inhibitors for cholesterol biosythesis | BRISTOL-MYERS (US) | 1991-04-30 | — | — | US | disclosed |