Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | GAA | P10253 | 1/20 | 0.62 |
| ▸ | DPP4 | P27487 | 6/20 | 0.57 |
| ▸ | DPP7 | Q9UHL4 | 6/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.57 |
| ▸ | CTSL | P07711 | 1/20 | 0.57 |
| ▸ | CTSB | P07858 | 1/20 | 0.57 |
| ▸ | CTSK | P43235 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.53 |
| ▸ | TGM2 | P21980 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL1870932 | 0.85 | ALDH1A1 (0.67) | TSHRALDH1A1GAADPP4DPP7 | |
| SCHEMBL27417332 | 0.83 | SMN1; SMN2 (0.70) | TSHRSMN1; SMN2CYP2C19MEN1KMT2A | |
| SCHEMBL7870 | 0.82 | L3MBTL1 (0.58) | TSHRALDH1A1GAADPP4DPP7 | |
| SCHEMBL30136006 | 0.82 | TSHR (0.60) | TSHRALDH1A1GAADPP4DPP7 | |
| SCHEMBL13161203 | 0.81 | HSD11B1 (0.72) | TSHRALDH1A1GAADPP4DPP7 | |
| SCHEMBL7137790 | 0.81 | SMN1; SMN2 (0.65) | TSHRALDH1A1GAADPP4DPP7 | |
| SCHEMBL2551898 | 0.81 | DPP4 (0.62) | TSHRALDH1A1GAADPP4DPP7 | |
| SCHEMBL4197556 | 0.81 | SMN1; SMN2 (0.67) | TSHRSMN1; SMN2CYP2C19MEN1KMT2A | |
| SCHEMBL29727241 | 0.81 | KMT2A (0.60) | TSHRALDH1A1GAADPP4DPP7 | |
| SCHEMBL3948456 | 0.80 | ALDH1A1 (0.85) | TSHRALDH1A1GAADPP4DPP7 |
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-1799672-A2 | CGRP RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 2007-06-27 | — | — | EP | disclosed |
| WO-2006041830-A2 | CGRP RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2006-04-20 | — | — | WO | disclosed |