Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.41 |
| ▸ | TUBB | P07437 | 2/20 | 0.41 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.41 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.41 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.41 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.41 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.41 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.41 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.41 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.41 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.41 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.41 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.41 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11436435 | 0.85 | HDAC4 (0.44) | CYP3A4HDAC4HDAC8 | |
| SCHEMBL20131281 | 0.83 | GABRA1 (0.57) | GABRA1GABRB2TRPA1PTGS1CACNA1C | |
| SCHEMBL1494320 | 0.80 | TRPA1 (0.56) | GABRA1GABRB2TRPA1PTGS1CACNA1C | |
| SCHEMBL13788860 | 0.80 | TUBB1 (0.53) | GABRA1GABRB2TRPA1PTGS1CACNA1C | |
| SCHEMBL31545189 | 0.80 | GABRA1 (0.44) | GABRA1GABRB2TRPA1PTGS1CACNA1C | |
| SCHEMBL17084596 | 0.79 | HDAC4 (0.40) | CYP3A4TUBB1HDAC4HDAC8 | |
| SCHEMBL6243516 | 0.79 | PKM (0.48) | GABRA1GABRB2PTGS1CYP3A4HDAC4 | |
| SCHEMBL12137640 | 0.76 | EGFR (0.44) | GABRA1GABRB2TRPA1PTGS1CACNA1C | |
| SCHEMBL12360643 | 0.76 | HDAC4 (0.38) | GABRA1GABRB2CYP3A4TUBB1HDAC4 | |
| SCHEMBL19726452 | 0.76 | HDAC4 (0.38) | CYP3A4TSHRNFKB1HDAC4HDAC8 |
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 |
|---|---|---|---|---|---|---|---|
| US-7557207-B2 | Spiro 2,4-pyrimidinediamine compounds and their uses | RIGEL PHARMACEUTICALS, INC. (US) | 2009-07-07 | — | — | US | disclosed |