Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | TMEM97 | Q5BJF2 | 4/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.37 |
| ▸ | HRH2 | P25021 | 2/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.37 |
| ▸ | HTR2C | P28335 | 2/20 | 0.37 |
| ▸ | HRH1 | P35367 | 2/20 | 0.37 |
| ▸ | HTR2B | P41595 | 2/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | HTR1B | P28222 | 1/20 | 0.37 |
| ▸ | HTR1E | P28566 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
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 SCHEMBL8564425 | 0.99 | ALDH1A1 (0.37) | ALDH1A1POLBTMEM97SIGMAR1HTR1A | |
| SCHEMBL8559780 | 0.91 | FHIT (0.36) | ALDH1A1TMEM97SIGMAR1HTR1ACHRM5 | |
| Hydrochloric Acid SCHEMBL8564478 | 0.90 | FHIT (0.36) | ALDH1A1TMEM97SIGMAR1HTR1ACHRM5 | |
| Hydrochloric Acid SCHEMBL8560332 | 0.89 | ALDH1A1 (0.35) | ALDH1A1POLBTMEM97SIGMAR1MAPK1 | |
| Hydrochloric Acid SCHEMBL8564923 | 0.84 | INSR (0.34) | ALDH1A1TMEM97SIGMAR1KDM4EHPGD | |
| Hydrochloric Acid SCHEMBL8565530 | 0.83 | NOTUM (0.33) | TMEM97SIGMAR1NOTUM | |
| Hydrochloric Acid SCHEMBL8560443 | 0.82 | KDM2B (0.35) | ALDH1A1POLBTMEM97SIGMAR1NOTUM | |
| SCHEMBL8560519 | 0.81 | TMEM97 (0.43) | ALDH1A1TMEM97SIGMAR1HTR1ACHRM5 | |
| Hydrochloric Acid SCHEMBL8561496 | 0.81 | TMEM97 (0.43) | ALDH1A1TMEM97SIGMAR1HTR1ACHRM5 | |
| SCHEMBL8563251 | 0.80 | ESR1 (0.39) | TMEM97SIGMAR1HTR1ACHRM5HRH2 |
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 |