Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | PYGL | P06737 | 1/20 | 0.33 |
| ▸ | DPEP1 | P16444 | 1/20 | 0.32 |
| ▸ | ICMT | O60725 | 1/20 | 0.32 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.32 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.32 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16649545 | 0.88 | TRPA1 (0.39) | TRPA1IDO1TSHRCASP1DPEP1 | |
| SCHEMBL16649875 | 0.82 | ALDH1A1 (0.39) | TRPA1IDO1TSHRCASP1DPEP1 | |
| SCHEMBL16649314 | 0.80 | IDO1 (0.36) | TRPA1IDO1LMNATSHRPYGL | |
| SCHEMBL12498864 | 0.76 | KCNA3 (0.37) | — | |
| SCHEMBL15157522 | 0.74 | TRPA1 (0.41) | TRPA1IDO1TSHRCASP1DPEP1 | |
| SCHEMBL16649568 | 0.74 | ALDH1A1 (0.48) | LMNAPYGLMAPTKMT2A | |
| SCHEMBL16649643 | 0.74 | ALDH1A1 (0.48) | PYGLMAPTKMT2A | |
| SCHEMBL16649920 | 0.74 | TSHR (0.39) | TRPA1IDO1LMNATSHRDPEP1 | |
| SCHEMBL12498442 | 0.71 | IDO1 (0.41) | TRPA1IDO1LMNATSHRPYGL | |
| SCHEMBL16961107 | 0.70 | TRPA1 (0.43) | TRPA1TSHRHDAC3HDAC4HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9133187-B2 | Serine/threonine kinase inhibitors | ARRAY BIOPHARMA INC. (US) | 2015-09-15 | — | — | US | claimed |
| EP-2681215-B1 | SERINE/THREONINE KINASE INHIBITORS | ARRAY BIOPHARMA INC (US) | 2015-04-22 | — | — | EP | claimed |