Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.36 |
| ▸ | TAS1R2 | Q8TE23 | 3/20 | 0.36 |
| ▸ | KISS1R | Q969F8 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.31 |
| ▸ | MMP1 | P03956 | 2/20 | 0.30 |
| ▸ | MMP2 | P08253 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23812642 | 0.81 | MEN1 (0.41) | CYP3A4CYP2C9CYP2C19SIGMAR1TAS1R3 | |
| SCHEMBL19988829 | 0.79 | HDAC3 (0.44) | CYP3A4CYP2C9CYP2C19SIGMAR1TAS1R3 | |
| SCHEMBL20056731 | 0.79 | CYP3A4 (0.43) | CYP3A4CYP2C9CYP2C19SIGMAR1TAS1R3 | |
| SCHEMBL11923590 | 0.79 | MEN1 (0.52) | KISS1RMEN1KMT2ASMN1; SMN2FAAH | |
| SCHEMBL23765942 | 0.78 | MEN1 (0.38) | CYP3A4CYP2C9CYP2C19SIGMAR1MEN1 | |
| SCHEMBL25444752 | 0.78 | CYP3A4 (0.42) | CYP3A4CYP2C9CYP2C19SIGMAR1TAS1R3 | |
| SCHEMBL25447623 | 0.78 | CYP3A4 (0.42) | CYP3A4CYP2C9CYP2C19SIGMAR1TAS1R3 | |
| SCHEMBL13826274 | 0.78 | PHF8 (0.43) | CYP3A4CYP2C9CYP2C19SIGMAR1TAS1R3 | |
| SCHEMBL1018455 | 0.77 | CYP3A4 (0.44) | CYP3A4CYP2C9CYP2C19SIGMAR1TAS1R3 | |
| SCHEMBL1018454 | 0.77 | CYP3A4 (0.44) | CYP3A4CYP2C9CYP2C19SIGMAR1TAS1R3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021127460-A1 | PCSK9 ANTAGONIST COMPOUNDS | MERCK SHARP & DOHME CORP. (US) | 2021-06-24 | — | — | WO | disclosed |