Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | USP8 | P40818 | 1/20 | 0.31 |
| ▸ | USP7 | Q93009 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.31 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.30 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20091719 | 0.88 | ALDH1A1 (0.41) | ALDH1A1HTTCYP1A2CYP3A4LMNA | |
| SCHEMBL23638029 | 0.79 | CYP1A2 (0.36) | ALDH1A1HTTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL20155929 | 0.75 | ALDH1A1 (0.41) | ALDH1A1HTTNR1H3 | |
| SCHEMBL20073204 | 0.74 | ALDH1A1 (0.41) | ALDH1A1HTTLMNAPOLB | |
| SCHEMBL22011492 | 0.70 | TSHR (0.46) | ALDH1A1HTTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL26916320 | 0.70 | TSHR (0.46) | ALDH1A1HTTCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL2634905 | 0.70 | KMT2A (0.45) | ALDH1A1CYP1A2CYP3A4CYP2D6NFKB1 | |
| SCHEMBL30014022 | 0.70 | TSHR (0.42) | ALDH1A1CYP1A2CYP3A4CYP2D6NFKB1 | |
| SCHEMBL23526257 | 0.70 | TSHR (0.42) | ALDH1A1CYP1A2CYP3A4CYP2D6NFKB1 | |
| SCHEMBL29946019 | 0.70 | TSHR (0.42) | ALDH1A1CYP1A2CYP3A4CYP2D6NFKB1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018075937-A1 | TYK2 INHIBITORS AND USES THEREOF | NIMBUS LAKSHMI, INC. (US) | 2018-04-26 | — | — | WO | disclosed |