Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR5 | Q9H228 | 5/20 | 0.48 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.48 |
| ▸ | FUCA1 | P04066 | 2/20 | 0.46 |
| ▸ | GRK5 | P34947 | 1/20 | 0.43 |
| ▸ | CDK8 | P49336 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | GBA1 | P04062 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29344046 | 0.86 | FUCA1 (0.55) | S1PR5S1PR1FUCA1ALDH1A1SIGMAR1 | |
| SCHEMBL27158527 | 0.86 | FUCA1 (0.55) | S1PR5S1PR1FUCA1ALDH1A1SIGMAR1 | |
| Trifluoroacetic Acid SCHEMBL18498099 | 0.77 | GRIN2B (0.58) | S1PR5S1PR1FUCA1GRK5CDK8 | |
| Trifluoroacetic Acid SCHEMBL18497330 | 0.76 | ACHE (0.45) | S1PR5S1PR1FUCA1SIGMAR1GBA1 | |
| SCHEMBL9686795 | 0.75 | OPRM1 (0.49) | S1PR5S1PR1FUCA1GRK5CDK8 | |
| Trifluoroacetic Acid SCHEMBL2267986 | 0.75 | SIGMAR1 (0.57) | HIF1AALDH1A1LMNAKMT2ASIGMAR1 | |
| Trifluoroacetic Acid SCHEMBL2267982 | 0.75 | SIGMAR1 (0.57) | HIF1AALDH1A1LMNAKMT2ASIGMAR1 | |
| Hydrochloric Acid SCHEMBL9687011 | 0.74 | OPRM1 (0.48) | S1PR5S1PR1FUCA1GRK5CDK8 | |
| Trifluoroacetic Acid SCHEMBL2269036 | 0.74 | ALDH1A1 (0.57) | HIF1AALDH1A1LMNAKMT2ASIGMAR1 | |
| Trifluoroacetic Acid SCHEMBL9038823 | 0.73 | S1PR5 (0.67) | S1PR5S1PR1KMT2A |
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-2022228568-A1 | PYRIDINO- OR PYRIMIDO-CYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF | 劲方医药科技(上海)有限公司 | 2022-11-03 | — | — | WO | disclosed |