Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RNF4 | P78317 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.44 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.44 |
| ▸ | BCL2A1 | Q16548 | 2/20 | 0.43 |
| ▸ | LDHA | P00338 | 1/20 | 0.42 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | TSPO | P30536 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL15053613 | 0.81 | CYP3A4 (0.45) | ALDH1A1BCL2A1TRPM8 | |
| SCHEMBL5702218 | 0.78 | RNF4 (0.51) | RNF4ALDH1A1TSHRKEAP1NFE2L2 | |
| SCHEMBL17628547 | 0.78 | RNF4 (0.58) | RNF4ALDH1A1TSHRKEAP1NFE2L2 | |
| SCHEMBL1429908 | 0.77 | RNF4 (0.45) | RNF4ALDH1A1TSHRKEAP1NFE2L2 | |
| SCHEMBL7044788 | 0.76 | TSHR (0.51) | RNF4ALDH1A1TSHRKEAP1NFE2L2 | |
| SCHEMBL15054037 | 0.75 | LTB4R2 (0.50) | RNF4TSHRKEAP1NFE2L2BCL2A1 | |
| SCHEMBL249712 | 0.74 | RNF4 (0.48) | RNF4ALDH1A1TSHRBCL2A1TRPM8 | |
| SCHEMBL11482380 | 0.73 | OPRM1 (0.42) | RNF4ALDH1A1TSHRBCL2A1TRPM8 | |
| SCHEMBL7106756 | 0.72 | KEAP1 (0.55) | RNF4TSHRKEAP1NFE2L2KMT2A | |
| SCHEMBL1337080 | 0.72 | USP2 (0.60) | RNF4ALDH1A1TSHRBCL2A1TRPM8 |
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-2013095301-A1 | METHOD OF PREPARING CHIRAL KETONES FROM ALDEHYDES | NANYANG TECHNOLOGICAL UNIVERSITY (SG) | 2013-06-27 | — | — | WO | disclosed |