Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.51 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL5329135 | 0.84 | ALDH1A1 (0.65) | ALDH1A1LMNAMAPK1CYP3A4CYP2D6 | |
| SCHEMBL5329766 | 0.83 | GAA (0.64) | ALDH1A1LMNATSHRGAAKMT2A | |
| SCHEMBL5338355 | 0.82 | TSHR (0.59) | ALDH1A1CYP3A4CYP2D6TSHRGAA | |
| SCHEMBL5422195 | 0.82 | GAA (0.62) | ALDH1A1LMNATSHRGAAKMT2A | |
| SCHEMBL14542393 | 0.81 | MEN1 (0.54) | ALDH1A1LMNAMAPK1CYP3A4CYP2D6 | |
| SCHEMBL5328964 | 0.81 | SMN1; SMN2 (0.75) | ALDH1A1LMNAMAPK1TSHRSMN1; SMN2 | |
| SCHEMBL14542019 | 0.80 | MEN1 (0.57) | ALDH1A1LMNAMAPK1CYP3A4CYP2D6 | |
| SCHEMBL5330985 | 0.80 | TSHR (0.56) | ALDH1A1LMNATSHRGAAKMT2A | |
| SCHEMBL5336800 | 0.78 | KMT2A (0.80) | ALDH1A1LMNATSHRGAAKMT2A | |
| SCHEMBL5425561 | 0.77 | RXFP1 (0.60) | ALDH1A1LMNAMAPK1CYP3A4CYP2D6 |
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-2007047394-A2 | THIOTRIAZOLYL DERIVATIVES | EPIX DELAWARE, INC. (US) | 2007-04-26 | — | — | WO | disclosed |