Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | HTR1A | P08908 | 9/20 | 0.45 |
| ▸ | HTR1B | P28222 | 8/20 | 0.45 |
| ▸ | HTR2A | P28223 | 3/20 | 0.45 |
| ▸ | HTR1D | P28221 | 8/20 | 0.43 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6987620 | 0.85 | THRA (0.45) | CYP2D6HTR1AHTR1BHTR2AHTR1D | |
| SCHEMBL7089914 | 0.84 | THRA (0.47) | CYP2D6HTR1AHTR1BHTR2AHTR1D | |
| SCHEMBL6523679 | 0.83 | KDM4E (0.49) | HTR1AHTR1BHTR1DTRPM8MTNR1A | |
| SCHEMBL6513222 | 0.83 | KDM4E (0.46) | CYP2D6HTR1AHTR1BHTR2AHTR1D | |
| SCHEMBL7090401 | 0.82 | HTR1A (0.52) | CYP2D6HTR1AHTR1BHTR2AHTR1D | |
| SCHEMBL7089278 | 0.80 | HTR1A (0.52) | CYP2D6HTR1AHTR1BHTR2AHTR1D | |
| SCHEMBL6983004 | 0.79 | HTR1A (0.45) | CYP2D6HTR1AHTR1BHTR2AHTR1D | |
| SCHEMBL6862010 | 0.78 | KDM4E (0.53) | HTR1AHTR1BHTR1DMTNR1AKDM4E | |
| SCHEMBL6989252 | 0.78 | HTR2B (0.49) | CYP2D6HTR1AHTR1BHTR2AHTR1D | |
| SCHEMBL6985820 | 0.78 | THRA (0.46) | CYP2D6HTR1AHTR1BHTR2AHTR1D |
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-1347959-A1 | INDOLE DERIVATIVES AS LIGANDS OF THYROID RECEPTORS | Bayer Aktiengesellschaft (DE) | 2003-10-01 | — | — | EP | disclosed |
| WO-2002051805-A1 | INDOLE DERIVATIVES AS LIGANDS OF THYROID RECEPTORS | BAYER AKTIENGESELLSCHAFT (DE) | 2002-07-04 | — | — | WO | disclosed |