Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FLT3 | P36888 | 3/20 | 0.39 |
| ▸ | TYRO3 | Q06418 | 3/20 | 0.39 |
| ▸ | MERTK | Q12866 | 3/20 | 0.39 |
| ▸ | GAS6 | Q14393 | 3/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.33 |
| ▸ | KMO | O15229 | 2/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.32 |
| ▸ | CDK9 | P50750 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10015003 | 0.88 | ESR2 (0.40) | CYP11B1CYP11B2NPC1RAB9AESR2 | |
| SCHEMBL12254194 | 0.83 | ESR2 (0.33) | FLT3TYRO3MERTKGAS6ESR2 | |
| SCHEMBL10015005 | 0.80 | ESR2 (0.42) | FLT3TYRO3MERTKGAS6NPC1 | |
| SCHEMBL12254134 | 0.79 | FLT3 (0.34) | FLT3TYRO3MERTKGAS6 | |
| SCHEMBL10015006 | 0.77 | FLT3 (0.33) | FLT3TYRO3MERTKGAS6 | |
| SCHEMBL9029730 | 0.77 | CYP2C9 (0.38) | CYP11B1CYP11B2NPC1TP53PKM | |
| SCHEMBL9029726 | 0.77 | CYP2C9 (0.38) | CYP11B1CYP11B2NPC1TP53PKM | |
| SCHEMBL9019416 | 0.76 | ESR2 (0.43) | CYP11B1CYP11B2NPC1RAB9AESR2 | |
| SCHEMBL10015008 | 0.76 | FLT3 (0.33) | FLT3TYRO3MERTKGAS6 | |
| SCHEMBL11190434 | 0.74 | ESR2 (0.54) | FLT3TYRO3MERTKGAS6NPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0456793-B1 | HALOPHENYL SUBSTITUTED HETEROCYCLIC DERIVATIVES | MERCK PATENT GMBH (DE) | 1996-10-23 | — | — | EP | disclosed |
| WO-1991009016-A2 | HALOPHENYL SUBSTITUTED HETEROCYCLIC DERIVATIVES | MERCK PATENT GMBH (DE) | 1991-06-27 | — | — | WO | disclosed |
| WO-1991009016-A1 | HALOPHENYL SUBSTITUTED HETEROCYCLIC DERIVATIVES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1991-06-27 | — | — | WO | disclosed |