Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ACLY | P53396 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.34 |
| ▸ | CTBP2 | P56545 | 2/20 | 0.34 |
| ▸ | TACR1 | P25103 | 2/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22445730 | 0.80 | TPMT (0.38) | TPMTIDO1TSHRACLYCNR1 | |
| SCHEMBL4632976 | 0.77 | NPC1 (0.50) | IDO1CTBP2 | |
| SCHEMBL12704178 | 0.76 | TPMT (0.42) | TPMTIDO1TSHRACLYCNR1 | |
| SCHEMBL868125 | 0.76 | CA2 (0.50) | TPMTTSHRACLY | |
| SCHEMBL9978973 | 0.76 | AKR1B1 (0.38) | TPMTTSHRP2RX7 | |
| SCHEMBL22442135 | 0.75 | HPGD (0.35) | TPMTIDO1ACLYCNR1 | |
| SCHEMBL48901 | 0.74 | IDO1 (0.43) | TPMTIDO1TSHRACLYCNR1 | |
| SCHEMBL3340425 | 0.74 | CA2 (0.46) | TPMTIDO1TSHREPHX1 | |
| SCHEMBL19895716 | 0.74 | IDO1 (0.39) | TPMTIDO1TSHRACLYCNR1 | |
| SCHEMBL4662034 | 0.74 | TACR1 (0.40) | TPMTACLYCNR1HCAR1CTBP2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1765793-A1 | CETP INHIBITORS | Merck and Co., Inc. (US) | 2007-03-28 | — | — | EP | disclosed |
| WO-2006014357-A1 | CETP INHIBITORS | MERCK & CO., INC. (US) | 2006-02-09 | — | — | WO | disclosed |
| WO-2006014413-A1 | CETP INHIBITORS | MERCK & CO., INC. (US) | 2006-02-09 | — | — | WO | disclosed |