Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FUCA1 | P04066 | 2/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CCR3 | P51677 | 1/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.45 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.45 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | GBA1 | P04062 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL31346974 | 0.82 | SIGMAR1 (0.53) | FUCA1SIGMAR1ACHECYP1A2CYP3A4 | |
| SCHEMBL20722495 | 0.81 | S1PR5 (0.49) | FUCA1CYP2D6ALDH1A1S1PR1S1PR5 | |
| SCHEMBL21797362 | 0.79 | FUCA1 (0.53) | FUCA1SIGMAR1ACHEALDH1A1S1PR1 | |
| SCHEMBL21737899 | 0.79 | FUCA1 (0.53) | FUCA1SIGMAR1ACHEALDH1A1S1PR1 | |
| SCHEMBL12078355 | 0.79 | FUCA1 (0.49) | FUCA1SIGMAR1ACHECYP1A2CYP3A4 | |
| SCHEMBL24767528 | 0.79 | FUCA1 (0.53) | FUCA1SIGMAR1ACHEALDH1A1S1PR1 | |
| SCHEMBL21797360 | 0.79 | FUCA1 (0.53) | FUCA1SIGMAR1ACHEALDH1A1S1PR1 | |
| SCHEMBL2302054 | 0.79 | FUCA1 (0.53) | FUCA1SIGMAR1ACHEALDH1A1S1PR1 | |
| SCHEMBL12078356 | 0.79 | FUCA1 (0.49) | FUCA1SIGMAR1ACHECYP1A2CYP3A4 | |
| SCHEMBL20163595 | 0.79 | FUCA1 (0.51) | FUCA1SIGMAR1ACHES1PR1S1PR5 |
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-116891488-A | Condensed-cyclic compound, pharmaceutical composition containing condensed-cyclic compound and application of condensed-cyclic compound | 成都海博为药业有限公司 | 2023-10-17 | — | — | CN | disclosed |