Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYCR1 | P32322 | 3/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.37 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.37 |
| ▸ | PRMT8 | Q9NR22 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL10151711 | 0.84 | CARM1 (0.55) | PYCR1KDM4EALDH1A1CARM1PRMT6 | |
| SCHEMBL16312619 | 0.74 | PYCR1 (0.65) | PYCR1NPSR1KDM4EALDH1A1KCNH2 | |
| SCHEMBL12082322 | 0.74 | PYCR1 (0.52) | PYCR1NPSR1KDM4EALDH1A1CARM1 | |
| SCHEMBL10065870 | 0.74 | PYCR1 (0.55) | PYCR1NPSR1KDM4EALDH1A1CARM1 | |
| SCHEMBL7297585 | 0.73 | PYCR1 (0.59) | PYCR1NPSR1KDM4EALDH1A1 | |
| SCHEMBL5949167 | 0.72 | CA12 (0.33) | TSHRMAPT | |
| SCHEMBL16088848 | 0.72 | PYCR1 (0.53) | PYCR1NPSR1KDM4EALDH1A1KMT2A | |
| SCHEMBL22537476 | 0.72 | PYCR1 (0.53) | PYCR1NPSR1KDM4EALDH1A1CARM1 | |
| SCHEMBL5028754 | 0.72 | PYCR1 (0.53) | PYCR1NPSR1KDM4EALDH1A1CARM1 | |
| SCHEMBL14373882 | 0.72 | PYCR1 (0.53) | PYCR1NPSR1KDM4EALDH1A1CARM1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3452475-B1 | TETRAHYDROPYRIMIDODIAZEPINE AND TETRAHYDROPYRIDODIAZEPINE COMPOUNDS FOR TREATING PAIN AND PAIN RELATED CONDITIONS | ESTEVE PHARMACEUTICALS SA (ES) | 2020-02-26 | — | — | EP | disclosed |