Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 5/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | STAT3 | P40763 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL12743776 | 0.80 | CYP2D6 (0.59) | CYP2D6CYP3A4LMNANPC1TSHR | |
| SCHEMBL96854 | 0.79 | KCNA3 (0.62) | L3MBTL1LTA4HALDH1A1TDP1KCNA3 | |
| SCHEMBL525095 | 0.78 | CYP2D6 (0.56) | CYP2D6CYP3A4LMNANPC1TSHR | |
| SCHEMBL19043241 | 0.78 | NQO1 (0.58) | LMNANPC1TSHRL3MBTL1LTA4H | |
| SCHEMBL4495036 | 0.77 | CYP2D6 (0.52) | CYP2D6CYP3A4LMNANPC1TSHR | |
| SCHEMBL19043239 | 0.76 | DRD2 (0.51) | NPC1L3MBTL1SMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL8437034 | 0.76 | DRD2 (0.58) | NPC1L3MBTL1KMT2ANPSR1KDM4E | |
| SCHEMBL21051894 | 0.76 | DRD4 (0.50) | TSHRL3MBTL1LTA4HALDH1A1KDM4E | |
| SCHEMBL27833683 | 0.76 | ALDH1A1 (0.39) | LMNAL3MBTL1SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL5540021 | 0.76 | DRD4 (0.51) | KMT2ANPSR1ALDH1A1RAB9A |
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-105189515-A | Furopyridines as bromodomain inhibitors | GLAXOSMITHKLINE IP NO 2 LTD | 2015-12-23 | — | — | CN | disclosed |