Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | PTGES2 | Q9H7Z7 | 3/20 | 0.41 |
| ▸ | ACLY | P53396 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.40 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.39 |
| ▸ | KIT | P10721 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22190937 | 0.85 | SMN1; SMN2 (0.44) | BRAFPTGS1PTGS2LMNAKMT2A | |
| SCHEMBL29356384 | 0.85 | SMN1; SMN2 (0.44) | BRAFPTGS1PTGS2LMNAKMT2A | |
| SCHEMBL856209 | 0.81 | CYP3A4 (0.57) | BRAFTHRBLMNAKMT2ACA1 | |
| SCHEMBL23141225 | 0.79 | ACLY (0.47) | BRAFPTGS1PTGS2ACLY | |
| SCHEMBL3019846 | 0.76 | CYP3A4 (0.49) | BRAFPTGS1PTGS2PSIP1CYP3A4 | |
| SCHEMBL10625554 | 0.75 | CA2 (0.66) | PTGS1PTGS2THRBLMNAKMT2A | |
| SCHEMBL7869189 | 0.75 | CYP2C9 (0.70) | BRAFPTGS1PTGS2PSIP1CYP3A4 | |
| SCHEMBL3364789 | 0.74 | THRB (0.51) | THRBLMNAKMT2ACA1CA2 | |
| SCHEMBL9321851 | 0.74 | KMT2A (0.55) | THRBLMNAKMT2ACA1CA2 | |
| SCHEMBL913405 | 0.73 | BRAF (0.56) | BRAFPTGS1PTGS2KITCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010129570-A1 | SOLID FORMS OF SULFONAMIDES AND AMINO ACIDS | PLEXXIKON, INC. (US) | 2010-11-11 | — | — | WO | disclosed |