Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 4/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.37 |
| ▸ | CCR5 | P51681 | 8/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | BRS3 | P32247 | 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 | |
|---|---|---|---|---|
| SCHEMBL25232753 | 1.00 | HTR6 (0.40) | HTR6NR1I2RORCNR1H2NR1H3 | |
| SCHEMBL26969777 | 0.93 | HTR6 (0.40) | HTR6NR1I2RORCNR1H2NR1H3 | |
| SCHEMBL26969766 | 0.90 | NPY5R (0.38) | HTR6NR1I2RORCNR1H2NR1H3 | |
| SCHEMBL25231173 | 0.86 | NPY5R (0.38) | NR1I2RORCNR1H2NR1H3P2RY1 | |
| SCHEMBL29387287 | 0.84 | CYP3A4 (0.41) | CYP3A4CYP2D6CYP2C9CYP2C19MEN1 | |
| SCHEMBL25276342 | 0.84 | CYP3A4 (0.41) | CYP3A4CYP2D6CYP2C9CYP2C19MEN1 | |
| SCHEMBL26969744 | 0.78 | HTR6 (0.40) | HTR6P2RY1OPRM1OPRD1OPRK1 | |
| SCHEMBL26969727 | 0.77 | NPY5R (0.42) | MEN1KMT2A | |
| SCHEMBL26969745 | 0.76 | HDAC1 (0.41) | HTR6OPRM1OPRD1 | |
| SCHEMBL26969707 | 0.75 | TSHR (0.38) | CYP3A4CYP2D6CYP2C9CYP2C19 |
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-4192957-A2 | TRPML MODULATORS | Casma Therapeutics, Inc. (US) | 2023-06-14 | — | — | EP | disclosed |
| WO-2022032073-A2 | TRPML MODULATORS | CASMA THERAPEUTICS, INC. (US) | 2022-02-10 | — | — | WO | disclosed |