Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.39 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.39 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| 4,4'-Methylenedianiline SCHEMBL16040933 | 0.84 | ALDH1A1 (0.61) | ALDH1A1CYP3A4TSHRTDP1TAAR1 | |
| SCHEMBL11571765 | 0.82 | TAAR1 (0.46) | TAAR1ACHEAOC3CYP19A1TACR1 | |
| SCHEMBL78261 | 0.82 | ACHE (0.52) | ALDH1A1TDP1TAAR1ACHEAOC3 | |
| SCHEMBL20067936 | 0.80 | TAAR1 (0.57) | ALDH1A1CYP3A4TSHRTDP1TAAR1 | |
| Hydrochloric Acid SCHEMBL6019075 | 0.80 | ACHE (0.50) | ALDH1A1TAAR1ACHEAOC3IDO1 | |
| Acetonitrile SCHEMBL11709097 | 0.77 | ACHE (0.48) | ALDH1A1TAAR1ACHENPC1RAB9A | |
| 4,4'-Methylenedianiline SCHEMBL6567022 | 0.74 | TSHR (0.64) | ALDH1A1CYP3A4TSHRTDP1TAAR1 | |
| SCHEMBL22051903 | 0.73 | ACHE (0.48) | ALDH1A1TAAR1ACHENPC1RAB9A | |
| Propionitrile SCHEMBL11710236 | 0.72 | AOC3 (0.41) | ALDH1A1TDP1TAAR1ACHEAOC3 | |
| SCHEMBL26782341 | 0.72 | CYP3A4 (0.67) | ALDH1A1CYP3A4TSHRTDP1ACHE |
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-2787017-A2 | Epoxy resin adducts and thermosets thereof | Dow Global Technologies LLC (US) | 2014-10-08 | — | — | EP | disclosed |
| US-20140275343-A1 | EPOXY RESIN ADDUCTS AND THERMOSETS THEREOF | DOW GLOBAL TECHNOLOGIES LLC (US) | 2014-09-18 | — | — | US | disclosed |