Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | ESR1 | P03372 | 4/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.40 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL29132874 | 0.91 | ESR1 (0.44) | LMNAALDH1A1TSHRESR1TDP1 | |
| SCHEMBL9495909 | 0.85 | LMNA (0.58) | LMNAALDH1A1TSHRESR1TDP1 | |
| SCHEMBL9496726 | 0.83 | ESR1 (0.58) | LMNAALDH1A1TSHRESR1TDP1 | |
| SCHEMBL4524002 | 0.80 | ALDH1A1 (0.59) | LMNAALDH1A1TSHRESR1CYP1A2 | |
| SCHEMBL671053 | 0.79 | CA12 (0.53) | LMNAALDH1A1TSHRESR1CYP1A2 | |
| SCHEMBL15869121 | 0.78 | LMNA (0.71) | LMNAALDH1A1TSHRESR1TDP1 | |
| Hydrochloric Acid SCHEMBL27813064 | 0.77 | CA12 (0.52) | LMNAALDH1A1TSHRESR1CYP1A2 | |
| Hydrochloric Acid SCHEMBL2863872 | 0.74 | SERPINE1 (0.38) | LMNAALDH1A1TSHRESR1TDP1 | |
| SCHEMBL827346 | 0.73 | HSD17B3 (0.52) | ALDH1A1TSHRTDP1SMN1; SMN2HPGD | |
| SCHEMBL9212901 | 0.72 | SIRT2 (0.40) | LMNAALDH1A1ESR1TDP1SLC6A2 |
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-117304130-A | MCL-1 inhibitors | 吉利德科学公司 | 2023-12-29 | — | — | CN | disclosed |