Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.36 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.35 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.35 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.35 |
| ▸ | WNT3A | P56704 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2994970 | 0.78 | PARP1 (0.41) | HSD17B10KDM4EALDH1A1HPGDPARP1 | |
| SCHEMBL10836335 | 0.74 | CYP2D6 (0.43) | HSD17B10KDM4EALDH1A1HPGDPARP1 | |
| SCHEMBL31259405 | 0.72 | POLB (0.40) | HSD17B10KDM4EALDH1A1HTTMAPT | |
| SCHEMBL28841329 | 0.69 | SMN1; SMN2 (0.46) | HSD17B10KDM4EALDH1A1HPGDPARP1 | |
| SCHEMBL31078773 | 0.66 | NAPRT (0.68) | HSD17B10KDM4EALDH1A1HPGDPARP1 | |
| SCHEMBL447126 | 0.66 | NAPRT (0.68) | HSD17B10KDM4EALDH1A1HPGDPARP1 | |
| SCHEMBL3726837 | 0.66 | HTT (0.53) | HSD17B10KDM4EALDH1A1HTTMAPT | |
| SCHEMBL12574809 | 0.66 | CYP2D6 (0.48) | HSD17B10KDM4EALDH1A1HTTNPSR1 | |
| SCHEMBL628397 | 0.65 | PARP1 (0.51) | HSD17B10KDM4EALDH1A1HPGDPARP1 | |
| SCHEMBL29687007 | 0.65 | PARP1 (0.51) | HSD17B10KDM4EALDH1A1HPGDPARP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2134689-A2 | INHIBITORS OF FOCAL ADHESION KINASE | The Scripps Research Institute (US) | 2009-12-23 | — | — | EP | disclosed |
| WO-2008115369-A2 | INHIBITORS OF FOCAL ADHESION KINASE | THE SCRIPPS RESEARCH INSTITUTE (US) | 2008-09-25 | — | — | WO | disclosed |