Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | MITF | O75030 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | MMP1 | P03956 | 1/20 | 0.48 |
| ▸ | MMP13 | P45452 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11537837 | 0.95 | CYP2D6 (0.53) | CYP2D6ALDH1A1KDM4EHSD17B10USP2 | |
| SCHEMBL11532901 | 0.81 | MEN1 (0.56) | ALDH1A1KDM4EHSD17B10SMN1; SMN2LMNA | |
| SCHEMBL11531641 | 0.78 | SMN1; SMN2 (0.67) | CYP2D6ALDH1A1KDM4EHSD17B10USP2 | |
| SCHEMBL11532976 | 0.78 | MEN1 (0.50) | ALDH1A1HSD17B10SMN1; SMN2LMNAMAPT | |
| SCHEMBL11531177 | 0.76 | KMT2A (0.67) | ALDH1A1KDM4EHSD17B10USP2SMN1; SMN2 | |
| SCHEMBL11528038 | 0.74 | SMN1; SMN2 (0.62) | CYP2D6ALDH1A1KDM4EHSD17B10USP2 | |
| SCHEMBL11530415 | 0.74 | NPSR1 (0.58) | ALDH1A1KDM4EHSD17B10USP2MAPT | |
| SCHEMBL23670350 | 0.73 | SMN1; SMN2 (0.47) | CYP2D6ALDH1A1KDM4ESMN1; SMN2MITF | |
| SCHEMBL23670346 | 0.73 | SMN1; SMN2 (0.47) | CYP2D6ALDH1A1KDM4ESMN1; SMN2MITF | |
| SCHEMBL23670546 | 0.73 | SMN1; SMN2 (0.47) | CYP2D6ALDH1A1KDM4ESMN1; SMN2MITF |
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-4155907-A | Method for inhibiting ADP-induced platelet aggregation using phenylthioalkylamines | THE DOW CHEMICAL COMPANY (US) | 1979-05-22 | — | — | US | claimed |