Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2953731 | 0.91 | CYP11B1 (0.50) | CYP11B1SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL29398562 | 0.91 | CYP11B1 (0.50) | CYP11B1SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL2953727 | 0.91 | CYP11B1 (0.50) | CYP11B1SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL6016300 | 0.91 | CYP11B1 (0.50) | CYP11B1SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL3446933 | 0.85 | CYP11B1 (0.47) | CYP11B1SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL29058653 | 0.80 | CYP11B1 (0.52) | CYP11B1SMN1; SMN2NPC1KDM4ECES2 | |
| SCHEMBL15962343 | 0.79 | CYP11B1 (0.51) | CYP11B1SMN1; SMN2NPC1CES2CES1 | |
| SCHEMBL2282849 | 0.78 | MEN1 (0.44) | CYP11B1SMN1; SMN2KDM4ECES2CES1 | |
| SCHEMBL1931607 | 0.78 | MEN1 (0.44) | CYP11B1SMN1; SMN2KDM4ECES2CES1 | |
| SCHEMBL3570354 | 0.78 | KMT2A (0.50) | CYP11B1SMN1; SMN2NPC1RAB9AKDM4E |
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-1727820-A2 | AMINE DERIVATIVES | MERCK PATENT GmbH (DE) | 2006-12-06 | — | — | EP | disclosed |
| WO-2005054246-A2 | AMINE DERIVATIVES HAVING A TYROSINE-KINASE-INHIBITING EFFECT | MERCK PATENT GMBH (DE) | 2005-06-16 | — | — | WO | disclosed |