Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | HRH2 | P25021 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 2/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.40 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | NPY1R | P25929 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29178356 | 1.00 | LMNA (0.42) | LMNASMN1; SMN2CYP1A2CYP2C19TDP1 | |
| SCHEMBL29178425 | 0.84 | SCN9A (0.42) | LMNASMN1; SMN2CYP1A2CYP2C19TDP1 | |
| SCHEMBL29117249 | 0.81 | MMP3 (0.48) | LMNACYP2C19 | |
| SCHEMBL29117246 | 0.81 | MMP3 (0.48) | LMNACYP2C19 | |
| SCHEMBL30050173 | 0.81 | CYP1A2 (0.47) | LMNASMN1; SMN2CYP1A2CYP2C19TDP1 | |
| SCHEMBL24815313 | 0.81 | CYP1A2 (0.47) | LMNASMN1; SMN2CYP1A2CYP2C19TDP1 | |
| SCHEMBL29178416 | 0.79 | MMP2 (0.39) | LMNAHRH1ALDH1A1MAPK1RAB9A | |
| SCHEMBL29178413 | 0.79 | MMP2 (0.39) | LMNAHRH1ALDH1A1MAPK1RAB9A | |
| SCHEMBL29178315 | 0.78 | MPO (0.38) | TAAR1NPC1RAB9A | |
| SCHEMBL29178313 | 0.78 | MPO (0.38) | TAAR1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-117561058-A | CDK2 inhibitors and methods of use thereof | 塞迪拉治疗股份有限公司 | 2024-02-13 | — | — | CN | disclosed |