Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.69 |
| ▸ | GAA | P10253 | 3/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.68 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.66 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.64 |
| ▸ | RAB9A | P51151 | 2/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.64 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.63 |
| ▸ | GNE | Q9Y223 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | MGAM | O43451 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.52 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL14627980 | 0.98 | TSHR (0.71) | TSHRGAAALDH1A1GRIN2BMAPK1 | |
| SCHEMBL2125829 | 0.88 | TSHR (0.56) | TSHRGAAALDH1A1GRIN2BMAPK1 | |
| SCHEMBL31520495 | 0.84 | TSHR (0.74) | TSHRGAAALDH1A1GRIN2BMAPK1 | |
| SCHEMBL5139469 | 0.84 | TSHR (0.66) | TSHRGAAALDH1A1GRIN2BMAPK1 | |
| SCHEMBL8061129 | 0.84 | TSHR (0.70) | TSHRGAAALDH1A1GRIN2BMAPK1 | |
| SCHEMBL17594997 | 0.84 | TSHR (0.66) | TSHRGAAALDH1A1GRIN2BMAPK1 | |
| Hydrochloric Acid SCHEMBL6586965 | 0.83 | TSHR (0.64) | TSHRGAAALDH1A1GRIN2BMAPK1 | |
| SCHEMBL17594912 | 0.83 | TSHR (0.56) | TSHRGAAALDH1A1GRIN2BMAPK1 | |
| SCHEMBL27297524 | 0.82 | GAA (1.00) | TSHRGAAALDH1A1GRIN2BMAPK1 | |
| SCHEMBL5161366 | 0.81 | MAPT (0.52) | TSHRGAAALDH1A1GRIN2BMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105764900-B | CRTH2 agonist compounds and application thereof | 广东东阳光药业有限公司 | 2018-04-03 | — | — | CN | disclosed |
| WO-2009041904-A1 | QUINOLINE COMPOUNDS HAVING AN ACTIVITY AGAINST THE GABAB RECEPTOR | ASTRAZENECA AB (SE) | 2009-04-02 | — | — | WO | disclosed |