Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.38 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ACACB | O00763 | 3/20 | 0.37 |
| ▸ | ACACA | Q13085 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | GALR3 | O60755 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29731124 | 1.00 | ALDH1A1 (0.43) | ALDH1A1TP53HTTNPSR1CYP2C9 | |
| SCHEMBL27077970 | 1.00 | ALDH1A1 (0.43) | ALDH1A1TP53HTTNPSR1CYP2C9 | |
| SCHEMBL28749473 | 0.92 | ALDH1A1 (0.46) | ALDH1A1TP53HTTNPSR1CYP2C9 | |
| SCHEMBL29705535 | 0.92 | ALDH1A1 (0.46) | ALDH1A1TP53HTTNPSR1CYP2C9 | |
| SCHEMBL28749471 | 0.92 | ALDH1A1 (0.46) | ALDH1A1TP53HTTNPSR1CYP2C9 | |
| SCHEMBL23163738 | 0.87 | ALDH1A1 (0.47) | ALDH1A1TP53HTTNPSR1CYP2C9 | |
| SCHEMBL23163736 | 0.87 | ALDH1A1 (0.47) | ALDH1A1TP53HTTNPSR1CYP2C9 | |
| SCHEMBL23163723 | 0.87 | ACACB (0.50) | ALDH1A1TP53HTTACACBACACA | |
| SCHEMBL23163686 | 0.87 | ALDH1A1 (0.42) | ALDH1A1TP53HTTNPSR1CYP2C9 | |
| SCHEMBL23164208 | 0.87 | ALOX5 (0.47) | ALDH1A1TP53HTTNPSR1ALOX5 |
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-4038052-B1 | PROSTAGLANDIN E2 (PGE2) EP4 RECEPTOR ANTAGONISTS | DOMAIN THERAPEUTICS (FR) | 2024-02-07 | — | — | EP | disclosed |
| CN-114555573-A | Prostaglandin E2(PGE2)EP4Receptor antagonists | 多曼治疗学公司 | 2022-05-27 | — | — | CN | disclosed |