Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.39 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19873254 | 0.84 | TSHR (0.58) | KDM4ETSHRHSD17B10ALDH1A1CYP3A4 | |
| SCHEMBL9525778 | 0.84 | KDM4E (0.55) | KDM4ETSHRHSD17B10CA9CYP3A4 | |
| SCHEMBL14341688 | 0.78 | NR1H2 (0.50) | KDM4ETSHRALDH1A1CA12CA1 | |
| SCHEMBL16898343 | 0.78 | CA12 (0.44) | KDM4ETSHRHSD17B10ALDH1A1PKM | |
| SCHEMBL3999898 | 0.78 | KDM4E (0.55) | KDM4ETSHRALDH1A1PKMCA12 | |
| SCHEMBL29633542 | 0.77 | TSHR (0.46) | KDM4ETSHRHSD17B10ALDH1A1CA12 | |
| SCHEMBL289285 | 0.77 | CA12 (0.55) | TSHRHSD17B10ALDH1A1CA12CA1 | |
| SCHEMBL31225318 | 0.76 | KDM4E (0.50) | KDM4ETSHRHSD17B10ALDH1A1PKM | |
| SCHEMBL31171418 | 0.76 | TSHR (0.60) | KDM4ETSHRHSD17B10ALDH1A1PKM | |
| SCHEMBL31171420 | 0.76 | TSHR (0.60) | KDM4ETSHRHSD17B10ALDH1A1PKM |
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 |
|---|---|---|---|---|---|---|---|
| CN-105612158-A | Antagonists of somatostatin receptor subtype 5 (sstr5) | TAKEDA PHARMACEUTICALS CO | 2016-05-25 | — | — | CN | disclosed |