Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.38 |
| ▸ | ATAD2 | Q6PL18 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 4/20 | 0.32 |
| ▸ | MMP3 | P08254 | 3/20 | 0.32 |
| ▸ | MMP9 | P14780 | 2/20 | 0.31 |
| ▸ | MMP1 | P03956 | 1/20 | 0.31 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.31 |
| ▸ | ADAM9 | Q13443 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7419667 | 0.82 | NOTUM (0.43) | HSD17B3ALDH1A1HPGDHDAC8NAMPT | |
| SCHEMBL7419302 | 0.80 | DPP7 (0.42) | KDM4EALDH1A1NAMPTMMP8MMP3 | |
| SCHEMBL7418416 | 0.73 | KDM4E (0.39) | NR1H2HSD17B3KDM4EALDH1A1HPGD | |
| SCHEMBL30431181 | 0.70 | CYP11B2 (0.44) | NR1H2HSD17B3ATAD2KDM4EALDH1A1 | |
| SCHEMBL2616872 | 0.69 | HSD17B3 (0.59) | NR1H2HSD17B3ATAD2KDM4EALDH1A1 | |
| SCHEMBL28464282 | 0.69 | PDK2 (0.43) | NR1H2HSD17B3ATAD2KDM4EALDH1A1 | |
| SCHEMBL14590717 | 0.66 | NOTUM (0.60) | NR1H2HSD17B3HDAC8PDK2NAMPT | |
| SCHEMBL21603396 | 0.64 | SMN1; SMN2 (0.42) | NR1H2HSD17B3ATAD2KDM4EALDH1A1 | |
| SCHEMBL29643084 | 0.64 | NOTUM (0.61) | HSD17B3ATAD2KDM4EALDH1A1PDK2 | |
| SCHEMBL5623740 | 0.64 | NOTUM (0.61) | HSD17B3ATAD2KDM4EALDH1A1PDK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5602145-A | Bicyclic fibrinogen antagonists | SMITHKLINE BEECHAM CORPORATION (US) | 1997-02-11 | — | — | US | disclosed |
| WO-1994029273-A1 | BICYCLIC FIBRINOGEN ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1994-12-22 | — | — | WO | disclosed |