Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.37 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.37 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28293275 | 0.85 | NPSR1 (0.46) | NPSR1ALDH1A1HTTTDP1HSD17B10 | |
| SCHEMBL6929857 | 0.84 | NPSR1 (0.44) | NPSR1ALDH1A1HTTTDP1HSD17B10 | |
| SCHEMBL6671813 | 0.84 | NPSR1 (0.44) | NPSR1ALDH1A1HTTTDP1HSD17B10 | |
| SCHEMBL7249303 | 0.83 | NPSR1 (0.43) | NPSR1ALDH1A1HTTTDP1HSD17B10 | |
| SCHEMBL4921605 | 0.83 | NPSR1 (0.43) | NPSR1ALDH1A1HTTTDP1HSD17B10 | |
| SCHEMBL27986058 | 0.82 | NPSR1 (0.43) | NPSR1ALDH1A1HTTTDP1HSD17B10 | |
| SCHEMBL7114177 | 0.79 | HSD17B10 (0.44) | NPSR1ALDH1A1TDP1HSD17B10MAPT | |
| SCHEMBL28096884 | 0.77 | CYP1A2 (0.46) | ALDH1A1TDP1HSD17B10MAPTMAOB | |
| SCHEMBL10520052 | 0.77 | NPSR1 (0.39) | NPSR1ALDH1A1HTTMAPT | |
| SCHEMBL20045675 | 0.76 | TDP1 (0.49) | NPSR1ALDH1A1HTTTDP1KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110354128-A | Pyrimidine FGFR4 inhibitors | 卫材R&D管理有限公司 | 2019-10-22 | — | — | CN | disclosed |
| CN-110049978-A | PIPERAZINE DERIVATIVES AS SELECTIVE HDAC1,2 INHIBITORS | 雷格南希制药有限责任公司 | 2019-07-23 | — | — | CN | disclosed |
| CN-105899490-B | Pyrimidine FGFR4 Inhibitors | 卫材R&D管理有限公司 | 2019-07-23 | — | — | CN | disclosed |
| CN-105899490-A | Pyrimidine fgfr4 inhibitors | 卫材R&D管理有限公司 | 2016-08-24 | — | — | CN | disclosed |