Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | KDM1A | O60341 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | CCR1 | P32246 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | NOS2 | P35228 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6399007 | 0.82 | CCR1 (0.55) | NPC1RAB9AKDM1AMEN1KMT2A | |
| SCHEMBL2880304 | 0.81 | SMN1; SMN2 (0.55) | NPC1RAB9AKDM1AMEN1KMT2A | |
| SCHEMBL6399505 | 0.81 | MCHR1 (0.47) | NPC1RAB9AKDM1AMEN1KMT2A | |
| SCHEMBL7506800 | 0.80 | MEN1 (0.52) | NPC1RAB9AKDM1AMEN1KMT2A | |
| SCHEMBL7501537 | 0.79 | APP (0.55) | NPC1RAB9AKDM1AMEN1KMT2A | |
| SCHEMBL7556949 | 0.79 | CHRM4 (0.61) | NPC1RAB9AKDM1AMEN1KMT2A | |
| SCHEMBL6611044 | 0.78 | MEN1 (0.50) | NPC1RAB9AKDM1AMEN1KMT2A | |
| SCHEMBL6161298 | 0.78 | MEN1 (0.50) | NPC1RAB9AKDM1AMEN1KMT2A | |
| SCHEMBL31559556 | 0.76 | SMN1; SMN2 (0.50) | NPC1RAB9AKDM1AMEN1KMT2A | |
| SCHEMBL8315488 | 0.76 | GRIN2B (0.50) | NPC1RAB9AKDM1AMEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6313307-B1 | DEBLOCKING, DEPROTECTING; CATALYTIC HYDROGENATION, ALKYLATION; PREPARING MICROBIOCIDES AGAINST STAPHYLOCOCCUS, STREPTOCOCCUS, MYCOBACTERIUM, AND CLOSTRIDIUM | PHARMACIA & UPJOHN COMPANY | 2001-11-06 | — | — | US | disclosed |