Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.34 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.34 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 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 | |
|---|---|---|---|---|
| SCHEMBL5332673 | 0.79 | CNR1 (0.33) | CNR1CNR2OPRL1POLBMEN1 | |
| SCHEMBL5135170 | 0.78 | OPRM1 (0.39) | CNR1CNR2OPRL1POLBKCNH2 | |
| SCHEMBL5134802 | 0.70 | PARP1 (0.51) | TAS1R3TAS1R1TAS1R2KCNH2PARP1 | |
| SCHEMBL1290783 | 0.65 | OPRM1 (0.35) | OPRL1KDM4EKMT2A | |
| SCHEMBL5134527 | 0.65 | SLC6A4 (0.39) | KDM4EPOLBMEN1KMT2AKCNH2 | |
| SCHEMBL19710924 | 0.63 | PDK2 (0.50) | KDM4EPOLBMEN1KMT2ADPP4 | |
| SCHEMBL19701885 | 0.63 | IDH1 (0.44) | KDM4EPOLBPARP1DPP4PIK3CD | |
| SCHEMBL9866928 | 0.63 | CES2 (0.49) | P2RX7CHRM1TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL8566777 | 0.63 | CES2 (0.61) | TAS1R3TAS1R1TAS1R2KMT2ACES2 | |
| SCHEMBL31270828 | 0.63 | CES2 (0.61) | TAS1R3TAS1R1TAS1R2KMT2ACES2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1942893-A2 | PIPERIDINE GLYCINE TRANSPORTER INHIBITORS | Merck & Co., Inc. (US) | 2008-07-16 | — | — | EP | disclosed |
| WO-2007053400-A2 | PIPERIDINE GLYCINE TRANSPORTER INHIBITORS | MERCK & CO., INC. (US) | 2007-05-10 | — | — | WO | disclosed |