Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.32 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL10599649 | 0.85 | KMT2A (0.58) | KMT2ALMNASRD5A2ESR1ESR2 | |
| SCHEMBL10492823 | 0.78 | LMNA (0.64) | KMT2ALMNASRD5A2PLA2G10PLA2G2A | |
| SCHEMBL20041199 | 0.76 | KMT2A (0.48) | KMT2ALMNASRD5A2ESR1ESR2 | |
| SCHEMBL18856115 | 0.76 | KMT2A (0.48) | KMT2ALMNASRD5A2ALDH1A1 | |
| SCHEMBL12228503 | 0.72 | IDO1 (0.46) | KMT2ASMN1; SMN2TDP1 | |
| SCHEMBL6704209 | 0.72 | THRB (0.44) | KMT2AESR1ESR2HDAC1THRA | |
| SCHEMBL6568210 | 0.72 | TRPA1 (0.36) | KMT2ALMNASRD5A2ALDH1A1SMN1; SMN2 | |
| SCHEMBL56361 | 0.71 | MAPT (0.40) | KMT2ALMNAESR1ESR2ALDH1A1 | |
| SCHEMBL23621838 | 0.70 | MMP13 (0.50) | KMT2ASRD5A2ALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL1362104 | 0.70 | ALDH1A1 (0.54) | KMT2AALDH1A1SMN1; SMN2TDP1THRA |
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-2753606-B1 | PYRIMIDINES AS SODIUM CHANNEL BLOCKERS | PURDUE PHARMA LP (US) | 2017-07-05 | — | — | EP | disclosed |