Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.37 |
| ▸ | LPAR5 | Q9H1C0 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL8444218 | 0.90 | PKM (0.44) | THRATHRBPOLBPKMALDH1A1 | |
| Hydrochloric Acid SCHEMBL8073687 | 0.89 | PKM (0.43) | THRATHRBPOLBPKMALDH1A1 | |
| SCHEMBL8068481 | 0.86 | THRA (0.43) | THRATHRBPOLBPKMALDH1A1 | |
| SCHEMBL8071065 | 0.86 | THRA (0.44) | THRATHRBPOLBPKMALDH1A1 | |
| Hydrochloric Acid SCHEMBL8070358 | 0.85 | THRA (0.39) | THRATHRBPOLBPKMALDH1A1 | |
| Hydrochloric Acid SCHEMBL8070361 | 0.84 | SLC9A1 (0.43) | — | |
| SCHEMBL8068670 | 0.82 | NOTUM (0.43) | THRATHRBALDH1A1HPGDNPSR1 | |
| SCHEMBL8068832 | 0.77 | PKM (0.43) | POLBPKMALDH1A1HPGDNPSR1 | |
| SCHEMBL8375529 | 0.77 | VCAM1 (0.48) | ALDH1A1HPGDNPSR1VCAM1SMN1; SMN2 | |
| SCHEMBL8075422 | 0.76 | PKM (0.48) | THRATHRBPOLBPKMKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-6057322-A | USEFUL IN TREATMENT OF CARDIOVASCULAR DISEASES | HOECHST AKTIENGESELLSCHAFT (DE) | 2000-05-02 | — | — | US | disclosed |