Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.33 |
| ▸ | FHIT | P49789 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | CCR2 | P41597 | 6/20 | 0.31 |
| ▸ | CCR1 | P32246 | 5/20 | 0.31 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.30 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8558842 | 0.85 | HTR6 (0.33) | FHITCCR2CCR1P2RX3CYP2D6 | |
| SCHEMBL8563251 | 0.78 | ESR1 (0.39) | ESR1ESR2HDAC6FHITPDE4B | |
| SCHEMBL8559448 | 0.78 | ESR1 (0.39) | ESR1ESR2HDAC6PDE4BPDE4D | |
| SCHEMBL8567196 | 0.78 | ESR1 (0.39) | ESR1ESR2HDAC6FHITPDE4B | |
| SCHEMBL8561833 | 0.75 | ESR1 (0.39) | ESR1ESR2HDAC6 | |
| SCHEMBL8559207 | 0.74 | MAPT (0.43) | ESR1ESR2CYP2D6 | |
| SCHEMBL8563245 | 0.74 | ESR1 (0.38) | ESR1ESR2HDAC6PDE4BPDE4D | |
| SCHEMBL8564189 | 0.72 | ESR1 (0.41) | ESR1ESR2HDAC6PDE4BPDE4D | |
| SCHEMBL8564198 | 0.72 | ESR1 (0.41) | ESR1ESR2HDAC6PDE4BPDE4D | |
| SCHEMBL8559199 | 0.72 | ESR1 (0.39) | ESR1ESR2PDE4BPDE4D |
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-5827849-A | HAVING INHIBITORY EFFECT ON INFLAMMATION AND BONE DEGRADATION, ANTITHROMBOTIC, ANTIAGGREGATORY AND TUMOR- OR METASTASIS-INHIBITING EFFECT | KARL THOMAE GMBH (DE) | 1998-10-27 | — | — | US | disclosed |