Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | RAB9A | P51151 | 1/20 | 0.61 |
| ▸ | SPHK1 | Q9NYA1 | 7/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CRHBP | P24387 | 2/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.41 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.41 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.41 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5923382 | 0.77 | MEN1 (0.42) | RAB9ASPHK1MAPTNPC1 | |
| SCHEMBL6510623 | 0.75 | RAB9A (0.67) | MAPK1RAB9ASPHK1CRHBPCRHR2 | |
| SCHEMBL4985481 | 0.74 | GRIN2D (0.68) | MAPK1RAB9ASPHK1GRIN2DGRIN3B | |
| SCHEMBL6517381 | 0.71 | SMN1; SMN2 (0.53) | MAPK1RAB9AMAPTCRHBPCRHR2 | |
| SCHEMBL4980238 | 0.71 | SIGMAR1 (0.71) | MAPK1RAB9AGRIN2DGRIN3BGRIN1 | |
| SCHEMBL4113089 | 0.70 | MAPT (0.46) | MAPK1RAB9AMAPTCRHBPCRHR2 | |
| SCHEMBL5923235 | 0.66 | KDM4E (0.39) | RAB9AMAPTNPC1CYP1A2 | |
| SCHEMBL1955157 | 0.64 | THRA (0.63) | SPHK1 | |
| SCHEMBL3428500 | 0.64 | THRA (0.55) | RAB9ASPHK1NPC1 | |
| SCHEMBL4979877 | 0.64 | SIGMAR1 (0.62) | MAPK1RAB9AGRIN2DGRIN3BGRIN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005095345-A2 | HETEROARYL GUANIDINES AS INHIBITORS OF VIRAL REPLICATION | ACHILLION PHARMACEUTICALS, INC. (US) | 2005-10-13 | — | — | WO | claimed |