Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.63 |
| ▸ | RAB9A | P51151 | 6/20 | 0.63 |
| ▸ | MAPT | P10636 | 4/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.58 |
| ▸ | TP53 | P04637 | 5/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7336243 | 0.81 | MAPT (0.63) | NPC1RAB9AMAPTSMN1; SMN2TP53 | |
| SCHEMBL6902568 | 0.81 | NPC1 (0.63) | NPC1RAB9AMAPTSMN1; SMN2TP53 | |
| SCHEMBL2792617 | 0.79 | NPC1 (0.70) | NPC1RAB9AMAPTSMN1; SMN2TP53 | |
| SCHEMBL2125044 | 0.79 | MAPT (0.70) | NPC1RAB9AMAPTSMN1; SMN2TP53 | |
| SCHEMBL155002 | 0.78 | MAPT (1.00) | NPC1RAB9AMAPTSMN1; SMN2TP53 | |
| SCHEMBL1420033 | 0.78 | TP53 (0.81) | NPC1RAB9AMAPTSMN1; SMN2TP53 | |
| SCHEMBL15662083 | 0.77 | MAPT (0.58) | NPC1RAB9AMAPTSMN1; SMN2TP53 | |
| SCHEMBL2434743 | 0.77 | RAB9A (0.58) | NPC1RAB9AMAPTSMN1; SMN2TP53 | |
| SCHEMBL6008059 | 0.77 | MAPT (0.58) | NPC1RAB9AMAPTSMN1; SMN2TP53 | |
| SCHEMBL6007999 | 0.77 | NPC1 (0.58) | NPC1RAB9AMAPTSMN1; SMN2TP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3016951-B1 | TRICYCLIC PYRIDO-CARBOXAMIDE DERIVATIVES AS ROCK INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2017-05-31 | — | — | EP | disclosed |