Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | LGALS8 | O00214 | 2/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 7/20 | 0.43 |
| ▸ | CA1 | P00915 | 6/20 | 0.43 |
| ▸ | CA12 | O43570 | 5/20 | 0.43 |
| ▸ | CA4 | P22748 | 4/20 | 0.43 |
| ▸ | CA5A | P35218 | 4/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.43 |
| ▸ | CA7 | P43166 | 3/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | MMP12 | P39900 | 1/20 | 0.42 |
| ▸ | F10 | P00742 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.38 |
| ▸ | FYN | P06241 | 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 | |
|---|---|---|---|---|
| SCHEMBL1703880 | 1.00 | CYP2D6 (0.49) | CYP2D6THRBHSD17B10LGALS8BCHE | |
| SCHEMBL14428890 | 1.00 | CYP2D6 (0.49) | CYP2D6THRBHSD17B10LGALS8BCHE | |
| SCHEMBL13387463 | 1.00 | CYP2D6 (0.49) | CYP2D6THRBHSD17B10LGALS8BCHE | |
| SCHEMBL22034630 | 1.00 | CYP2D6 (0.49) | CYP2D6THRBHSD17B10LGALS8BCHE | |
| SCHEMBL314061 | 0.89 | CYP2D6 (0.51) | CYP2D6THRBHSD17B10LGALS8CA2 | |
| SCHEMBL8089407 | 0.89 | CYP2D6 (0.51) | CYP2D6THRBHSD17B10LGALS8CA2 | |
| SCHEMBL13928976 | 0.89 | CYP2D6 (0.51) | CYP2D6THRBHSD17B10LGALS8CA2 | |
| SCHEMBL314060 | 0.89 | CYP2D6 (0.51) | CYP2D6THRBHSD17B10LGALS8CA2 | |
| SCHEMBL3972810 | 0.89 | CYP2D6 (0.51) | CYP2D6THRBHSD17B10LGALS8CA2 | |
| SCHEMBL6230386 | 0.89 | CYP2D6 (0.51) | CYP2D6THRBHSD17B10LGALS8CA2 |
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-4251515-A | ANTITUMOR AGENTS, TREATMENT OF LEUKEMIA | SUAMI T | 1981-02-17 | — | — | US | disclosed |