Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 4/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.30 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 2/20 | 0.30 |
| ▸ | HPGD | P15428 | 2/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL2672681 | 0.84 | ALDH1A1 (0.38) | ALDH1A1KDM4EGAAMAPTHPGD | |
| SCHEMBL2628871 | 0.75 | NR4A2 (0.35) | — | |
| SCHEMBL2254864 | 0.74 | CYP2D6 (0.41) | ALDH1A1KDM4E | |
| SCHEMBL20422633 | 0.72 | JAK2 (0.42) | MTNR1AMTNR1BALDH1A1KDM4EMAPT | |
| SCHEMBL2259078 | 0.72 | SMN1; SMN2 (0.34) | ALDH1A1NPC1RAB9AKDM4EGAA | |
| SCHEMBL9755930 | 0.71 | CSNK2A2 (0.48) | MTNR1AMTNR1BALDH1A1NPC1RAB9A | |
| SCHEMBL9937273 | 0.70 | LRRK2 (0.47) | MTNR1AMTNR1BALDH1A1NPC1RAB9A | |
| SCHEMBL2255704 | 0.70 | CSNK2A2 (0.35) | ALDH1A1NPC1RAB9AMAPTHPGD | |
| SCHEMBL3992292 | 0.70 | CFB (0.32) | — | |
| SCHEMBL12751060 | 0.69 | KDM5A (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101018781-A | Bicyclic N-anilide spirolactam CGRP receptor antagonists | MERCK & CO INC (US) | 2007-08-15 | — | — | CN | disclosed |