Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 4/20 | 0.46 |
| ▸ | TRPV3 | Q8NET8 | 2/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | SORD | Q00796 | 2/20 | 0.38 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24922389 | 0.83 | ALDH1A1 (0.40) | CYP11B1CYP11B2PIM2KMT2AMEN1 | |
| SCHEMBL2724262 | 0.83 | HTR2C (0.58) | PIM2KMT2AMEN1CYP3A4CYP2C9 | |
| SCHEMBL16366822 | 0.81 | PDE10A (0.51) | PDE10ATRPV3CYP11B1CYP11B2PIM2 | |
| SCHEMBL15537495 | 0.75 | TRPV3 (0.58) | PDE10ATRPV3 | |
| SCHEMBL29600540 | 0.73 | MAPT (0.41) | PIM2KMT2AMEN1CYP3A4CYP2C9 | |
| SCHEMBL24324092 | 0.73 | MAPT (0.41) | PIM2KMT2AMEN1CYP3A4CYP2C9 | |
| SCHEMBL12186828 | 0.73 | CYP1A2 (0.42) | PDE10ACYP11B1CYP11B2PIM2KMT2A | |
| SCHEMBL15537503 | 0.73 | TRPV3 (0.57) | PDE10ATRPV3SORD | |
| SCHEMBL17221263 | 0.73 | UBE2T (0.40) | SORDALDH1A1LMNA | |
| SCHEMBL21875342 | 0.72 | SMN1; SMN2 (0.46) | TRPV3KMT2AMEN1CYP2C19CYP1A2 |
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-2022076622-A2 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |