Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYCR1 | P32322 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | FPR2 | P25090 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL27647959 | 0.88 | CYP1A2 (0.37) | PYCR1HTR2AFPR2CYP1A2ALOX5 | |
| SCHEMBL22798698 | 0.81 | CYP2A6 (0.39) | KMT2AHTR2ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9397854 | 0.80 | CHRNA7 (0.38) | SLC6A2SLC6A4SLC6A3ALOX5ALDH1A1 | |
| SCHEMBL6679840 | 0.80 | TSHR (0.44) | SLC6A2SLC6A4SLC6A3HPGDCYP2A6 | |
| SCHEMBL3838715 | 0.80 | HTR2A (0.38) | PYCR1KMT2AHTR2ACYP1A2ALOX5 | |
| SCHEMBL537301 | 0.78 | HTR2A (0.36) | PYCR1KMT2AHTR2ACYP1A2ALOX5 | |
| SCHEMBL7432877 | 0.78 | ESR1 (0.53) | SLC6A2SLC6A3CYP1A2ALDH1A1CYP3A4 | |
| SCHEMBL6224183 | 0.78 | ALDH1A1 (0.40) | KMT2ASLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL7979678 | 0.77 | HTR2A (0.48) | PYCR1KMT2AHTR2AFPR2SLC6A2 | |
| SCHEMBL19901495 | 0.77 | ESR1 (0.47) | PYCR1KMT2AHTR2AFPR2SLC6A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0985649-B1 | Method for producing an aromatic compound having an alkyl group with at least three carbon atoms | TORAY INDUSTRIES (JP) | 2004-11-24 | — | — | EP | disclosed |
| US-6462248-B1 | THROUGH CONVERSION, ISOMERIZATION AND/OR ADSORPTIVE SEPARATION OF AROMATIC COMPOUNDS | TORAY INDUSTRIES, INC. (JP) | 2002-10-08 | — | — | US | disclosed |
| EP-0985649-A2 | Method for producing an aromatic compound having an alkyl group with at least three carbon atoms | TORAY INDUSTRIES, INC. (JP) | 2000-03-15 | — | — | EP | disclosed |