Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KRAS | P01116 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HTR1D | P28221 | 3/20 | 0.35 |
| ▸ | HTR6 | P50406 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | HTR3A | P46098 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | RAD52 | P43351 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | HRH1 | P35367 | 1/20 | 0.30 |
| ▸ | HRH4 | Q9H3N8 | 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 | |
|---|---|---|---|---|
| SCHEMBL3234397 | 0.84 | KRAS (0.42) | KRASSMN1; SMN2HTR1DHTR6CYP1A2 | |
| SCHEMBL13496829 | 0.82 | KRAS (0.41) | KRASSMN1; SMN2HTR1DHTR6CYP1A2 | |
| SCHEMBL3235011 | 0.80 | TAAR1 (0.42) | KRASSMN1; SMN2HTR1DHTR6CYP1A2 | |
| SCHEMBL3234804 | 0.77 | CYP1A2 (0.43) | KRASSMN1; SMN2HTR1DHTR6CYP1A2 | |
| SCHEMBL3638115 | 0.76 | KRAS (0.43) | KRASSMN1; SMN2HTR1DHTR6CYP1A2 | |
| Hydrochloric Acid SCHEMBL3622627 | 0.76 | SMN1; SMN2 (0.43) | KRASSMN1; SMN2HTR1DHTR6CYP1A2 | |
| SCHEMBL3235519 | 0.75 | KRAS (0.45) | KRASSMN1; SMN2HTR1DHTR6CYP1A2 | |
| Hydrochloric Acid SCHEMBL3582811 | 0.74 | SMN1; SMN2 (0.47) | KRASSMN1; SMN2HTR1DHTR6CYP1A2 | |
| SCHEMBL3232722 | 0.72 | KRAS (0.45) | KRASSMN1; SMN2HTR1DHTR6CYP1A2 | |
| SCHEMBL13496942 | 0.72 | KRAS (0.42) | KRASSMN1; SMN2HTR1DHTR6CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010012396-A1 | 5,6 SUBSTITUTED BENZAMIDE DERIVATIVES AS MODULATORS OF THE EP<SB>2 </SB>RECEPTOR | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-02-04 | — | — | WO | disclosed |
| EP-2149552-A1 | 5,6 substituted benzamide derivatives as modulators of EP2 receptors | Bayer Schering Pharma AG (DE) | 2010-02-03 | — | — | EP | disclosed |