Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.36 |
| ▸ | TMEM97 | Q5BJF2 | 8/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 8/20 | 0.34 |
| ▸ | HTR1A | P08908 | 2/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.34 |
| ▸ | HRH2 | P25021 | 2/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | HRH1 | P35367 | 2/20 | 0.34 |
| ▸ | HTR2B | P41595 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | HTR1B | P28222 | 1/20 | 0.34 |
| ▸ | HTR1E | P28566 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 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 | |
|---|---|---|---|---|
| SCHEMBL8561814 | 0.79 | ESR1 (0.36) | ESR1ESR2TMEM97SIGMAR1HTR1A | |
| SCHEMBL8562345 | 0.73 | ESR1 (0.39) | ESR1ESR2TMEM97SIGMAR1HTR1A | |
| SCHEMBL8562282 | 0.72 | ESR1 (0.35) | ESR1ESR2TMEM97SIGMAR1HTR1A | |
| SCHEMBL8895074 | 0.72 | ESR1 (0.39) | ESR1ESR2TMEM97SIGMAR1HTR1A | |
| SCHEMBL8895079 | 0.72 | ESR1 (0.39) | ESR1ESR2TMEM97SIGMAR1HTR1A | |
| SCHEMBL8562631 | 0.69 | TMEM97 (0.39) | ESR1ESR2TMEM97SIGMAR1HTR1A | |
| SCHEMBL7472118 | 0.69 | ESR1 (0.41) | ESR1ESR2TMEM97SIGMAR1HTR1A | |
| SCHEMBL7560796 | 0.68 | ESR1 (0.42) | ESR1ESR2TMEM97SIGMAR1HTR1A | |
| SCHEMBL7472374 | 0.67 | TMEM97 (0.43) | ESR1ESR2TMEM97SIGMAR1HTR1A | |
| SCHEMBL7474127 | 0.65 | TMEM97 (0.43) | ESR1ESR2TMEM97SIGMAR1HTR1A |
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 |