Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.41 |
| ▸ | TYR | P14679 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | MIF | P14174 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | APEX1 | P27695 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 2/20 | 0.35 |
| ▸ | BLM | P54132 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9660619 | 0.83 | TYR (0.44) | TYR | |
| SCHEMBL7150196 | 0.83 | TAAR1 (0.54) | CYP3A4TSHRADRA2AADRA2BADRA2C | |
| SCHEMBL9150470 | 0.82 | ADRA2A (0.38) | ADRA2AADRA2BADRA2CTYRLMNA | |
| SCHEMBL2987382 | 0.81 | ADRA2A (0.43) | CYP3A4TSHRADRA2AADRA2BADRA2C | |
| SCHEMBL109440 | 0.79 | CYP3A4 (0.43) | CYP3A4TSHRADRA2AADRA2BADRA2C | |
| SCHEMBL2805269 | 0.79 | ADRA2A (0.36) | ADRA2AADRA2BADRA2CTYRLMNA | |
| SCHEMBL302560 | 0.77 | TYR (0.44) | CYP3A4ADRA2AADRA2BADRA2CTYR | |
| SCHEMBL31392615 | 0.76 | ALDH1A1 (0.41) | ADRA2AADRA2BADRA2CTYRLMNA | |
| SCHEMBL31392616 | 0.76 | ADRA2A (0.47) | CYP3A4TSHRADRA2AADRA2BADRA2C | |
| SCHEMBL8746279 | 0.75 | ESR2 (0.46) | CYP3A4TSHRADRA2AADRA2BADRA2C |
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 |
|---|---|---|---|---|---|---|---|
| US-5389286-A | Form films with good strength and mechanical integrity, can be blended with polyesters for fibers | UNIVERSITY OF MASSACHUSETTS AT AMHERST (US) | 1995-02-14 | — | — | US | disclosed |
| WO-1994009194-A1 | LIQUID CRYSTAL COPOLYMER CONTAINING ALKOXY-SUBSTITUTED PARA-PHENYLENE TEREPHTHALATE GROUPS | UNIVERSITY OF MASSACHUSETTS AT AMHERST (US) | 1994-04-28 | — | — | WO | disclosed |