Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.65 |
| ▸ | TSHR | P16473 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5334239 | 0.84 | GAA (0.60) | ALDH1A1TSHRSMN1; SMN2MAPK1KMT2A | |
| SCHEMBL5329256 | 0.84 | ALDH1A1 (0.58) | ALDH1A1TSHRSMN1; SMN2MAPK1KMT2A | |
| SCHEMBL5333893 | 0.83 | GAA (0.58) | ALDH1A1TSHRSMN1; SMN2MAPK1KMT2A | |
| SCHEMBL5332292 | 0.82 | GAA (0.58) | ALDH1A1TSHRSMN1; SMN2KMT2ALMNA | |
| SCHEMBL5332021 | 0.81 | SMN1; SMN2 (0.74) | ALDH1A1TSHRSMN1; SMN2KMT2ALMNA | |
| SCHEMBL5332827 | 0.81 | GAA (0.56) | ALDH1A1TSHRSMN1; SMN2KMT2ALMNA | |
| SCHEMBL14542019 | 0.76 | MEN1 (0.57) | ALDH1A1TSHRMAPK1KMT2ALMNA | |
| SCHEMBL5418863 | 0.76 | ALDH1A1 (0.69) | ALDH1A1TSHRSMN1; SMN2MAPK1KMT2A | |
| SCHEMBL14542393 | 0.75 | MEN1 (0.54) | ALDH1A1TSHRSMN1; SMN2MAPK1KMT2A | |
| SCHEMBL5361725 | 0.75 | ALDH1A1 (0.66) | ALDH1A1TSHRSMN1; SMN2KMT2ACYP3A4 |
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 |