Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 2/20 | 0.40 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.39 |
| ▸ | TPSD1 | Q9BZJ3 | 2/20 | 0.39 |
| ▸ | TPSG1 | Q9NRR2 | 2/20 | 0.39 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | SYK | P43405 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.35 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13397932 | 0.93 | TPSAB1 (0.43) | ABCB1TPSAB1TPSD1TPSG1FOLH1 | |
| SCHEMBL1197947 | 0.93 | TPSAB1 (0.43) | ABCB1TPSAB1TPSD1TPSG1FOLH1 | |
| SCHEMBL19244966 | 0.84 | ABCB1 (0.47) | ABCB1FOLH1ALDH1A1SYKKDM4E | |
| SCHEMBL13007477 | 0.82 | ALDH1A1 (0.42) | TPSAB1TPSD1TPSG1ALDH1A1SYK | |
| SCHEMBL16286028 | 0.82 | ABCB1 (0.49) | ABCB1TPSAB1TPSD1TPSG1ALDH1A1 | |
| SCHEMBL11007681 | 0.81 | FOLH1 (0.43) | TPSAB1TPSD1TPSG1FOLH1ALDH1A1 | |
| SCHEMBL12873853 | 0.80 | L3MBTL1 (0.44) | TPSAB1TPSD1TPSG1ALDH1A1SYK | |
| SCHEMBL2707289 | 0.80 | TPSAB1 (0.40) | ABCB1TPSAB1TPSD1TPSG1FOLH1 | |
| SCHEMBL17369164 | 0.79 | SYK (0.46) | TPSAB1TPSD1TPSG1ALDH1A1SYK | |
| SCHEMBL14744316 | 0.79 | TPSAB1 (0.43) | TPSAB1TPSD1TPSG1ALDH1A1SYK |
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-1804919-A2 | CGRP RECEPTOR ANTAGONISTS | Merck & Co., Inc. (US) | 2007-07-11 | — | — | EP | disclosed |
| WO-2006047196-A2 | CGRP RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2006-05-04 | — | — | WO | disclosed |