Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.31 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | CCR2 | P41597 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | ABHD6 | Q9BV23 | 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 | |
|---|---|---|---|---|
| SCHEMBL8559776 | 0.89 | HTR6 (0.35) | BACE1HDAC6TMEM97SIGMAR1RAB9A | |
| Hydrochloric Acid SCHEMBL8564477 | 0.88 | HTR6 (0.34) | BACE1HDAC6TMEM97SIGMAR1RAB9A | |
| Hydrochloric Acid SCHEMBL8564921 | 0.86 | INSR (0.34) | TMEM97SIGMAR1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8569203 | 0.86 | HTR6 (0.34) | BACE1 | |
| SCHEMBL8558357 | 0.83 | ESR1 (0.37) | ESR1ESR2PDE4BPDE4DHDAC6 | |
| Iodide SCHEMBL8600500 | 0.83 | ACHE (0.38) | BACE1HDAC6TMEM97SIGMAR1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8566136 | 0.83 | ACHE (0.38) | BACE1HDAC6RAB9ASMN1; SMN2 | |
| SCHEMBL8563645 | 0.81 | TMEM97 (0.36) | TMEM97SIGMAR1KCNH2 | |
| SCHEMBL8559199 | 0.81 | ESR1 (0.39) | ESR1ESR2BACE1PDE4BPDE4D | |
| Hydrochloric Acid SCHEMBL8564421 | 0.80 | TMEM97 (0.36) | TMEM97SIGMAR1KCNH2 |
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 |