Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.36 |
| ▸ | PARP1 | P09874 | 6/20 | 0.35 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
| ▸ | DRD1 | P21728 | 2/20 | 0.34 |
| ▸ | DRD5 | P21918 | 2/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.34 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.34 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8559857 | 0.97 | PARP1 (0.36) | TMEM97SIGMAR1PARP1DRD1DRD5 | |
| SCHEMBL8562403 | 0.87 | HTR6 (0.40) | PARP1DRD1DRD2 | |
| SCHEMBL8559323 | 0.83 | PARP1 (0.37) | TMEM97SIGMAR1PARP1 | |
| SCHEMBL8557053 | 0.83 | HTR6 (0.41) | PARP1PTK2 | |
| SCHEMBL8560491 | 0.82 | HTR6 (0.43) | PARP1 | |
| SCHEMBL8564812 | 0.80 | ESR1 (0.31) | — | |
| SCHEMBL8559860 | 0.80 | PARP1 (0.39) | SIGMAR1PARP1 | |
| Hydrochloric Acid SCHEMBL8563477 | 0.79 | PARP1 (0.38) | SIGMAR1PARP1 | |
| SCHEMBL8573544 | 0.74 | P2RX3 (0.35) | — | |
| Hydrochloric Acid SCHEMBL8560445 | 0.73 | QPCT (0.39) | TMEM97SIGMAR1PARP1DRD1KEAP1 |
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 |