Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SNCA | P37840 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14306936 | 0.82 | TSHR (0.42) | TSHRAPPALDH1A1ALOX15HSD17B10 | |
| SCHEMBL6225564 | 0.82 | TSHR (0.42) | TSHRAPPALDH1A1ALOX15HSD17B10 | |
| SCHEMBL1724944 | 0.73 | TSHR (0.41) | TSHRAPPALDH1A1ALOX15HSD17B10 | |
| SCHEMBL10623333 | 0.73 | TSHR (0.33) | TSHRAPPALDH1A1ALOX15HSD17B10 | |
| SCHEMBL879287 | 0.73 | — | — | |
| SCHEMBL12488906 | 0.73 | — | — | |
| SCHEMBL3750531 | 0.71 | CHRNB4 (0.35) | TSHRAPPALDH1A1ALOX15HSD17B10 | |
| SCHEMBL22250113 | 0.71 | RAPGEF4 (0.36) | TSHRAPPALDH1A1ALOX15HSD17B10 | |
| SCHEMBL15928724 | 0.71 | ALDH1A1 (0.42) | TSHRAPPALDH1A1ALOX15HSD17B10 | |
| SCHEMBL10344905 | 0.71 | CA12 (0.55) | TSHRAPPALDH1A1ALOX15HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2200436-B1 | SUBSTITUTED PYRIMIDINYL-AMINES AS PROTEIN KINASE INHIBITORS | SCRIPPS RESEARCH INST (US) | 2015-01-21 | — | — | EP | disclosed |