Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL5146834 | 0.83 | KMT2A (0.32) | KMT2AALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL5134530 | 0.74 | PARP1 (0.33) | PARP1 | |
| SCHEMBL5134331 | 0.66 | RAB9A (0.39) | KMT2AALDH1A1KDM4EHPGDRAB9A | |
| SCHEMBL5134122 | 0.64 | PARP1 (0.41) | KMT2AKDM4EHPGDPARP1NPC1 | |
| SCHEMBL5134806 | 0.63 | PARP2 (0.39) | PARP1 | |
| SCHEMBL4763827 | 0.61 | PARP1 (0.54) | KMT2AALDH1A1KDM4EMAPTHPGD | |
| SCHEMBL5808501 | 0.58 | HTR2C (0.44) | KMT2APARP1 | |
| SCHEMBL17594488 | 0.58 | GABRA1 (0.34) | KMT2APARP1 | |
| SCHEMBL1691748 | 0.57 | ALDH1A1 (0.37) | KMT2AALDH1A1KDM4EHPGDRAB9A | |
| SCHEMBL30970522 | 0.57 | PARP1 (0.44) | KMT2AALDH1A1KDM4EHPGDPARP1 |
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 |