Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.45 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HTR1D | P28221 | 1/20 | 0.40 |
| ▸ | HTR1B | P28222 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | THRA | P10827 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | REN | P00797 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4750822 | 0.80 | CHRNB2 (0.44) | CHRNB2CHRNA4ESR1ESR2KDM4E | |
| SCHEMBL8550551 | 0.78 | HTR1B (0.41) | ESR1ESR2KDM4EHTR1DHTR1B | |
| SCHEMBL21588916 | 0.76 | CYP19A1 (0.48) | CYP19A1MEN1KMT2A | |
| SCHEMBL29814530 | 0.76 | CYP19A1 (0.48) | CYP19A1MEN1KMT2A | |
| SCHEMBL8551515 | 0.76 | ALDH1A1 (0.43) | CHRNB2CHRNA4ESR1ESR2MEN1 | |
| SCHEMBL29814593 | 0.74 | KDM4E (0.40) | KDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL21588776 | 0.74 | KDM4E (0.40) | KDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL4753173 | 0.74 | MAPT (0.41) | CHRNB2CHRNA4KDM4EGAACYP19A1 | |
| SCHEMBL8549856 | 0.73 | ALDH1A1 (0.33) | CHRNB2CHRNA4ESR1ESR2MEN1 | |
| SCHEMBL7484667 | 0.71 | ALDH1A1 (0.42) | HTR1DHTR1BCYP19A1MEN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0736025-B1 | DYHYDROBENZOFURANYL-BIPHENYL CARBOXAMIDES HAVING 5HT1D ANTAGONISTIC ACTIVITY | SMITHKLINE BEECHAM PLC (GB) | 1998-07-22 | — | — | EP | disclosed |
| US-5700818-A | Dihydrobenzofuranyl-biphenyl carboxamides having 5HT1D antagonistic activity | SMITHKLINE BEECHAM P.L.C. (GB) | 1997-12-23 | — | — | US | disclosed |