Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | PBK | Q96KB5 | 3/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.50 |
| ▸ | SMYD3 | Q9H7B4 | 5/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | SUV39H1 | O43463 | 2/20 | 0.46 |
| ▸ | PRMT1 | Q99873 | 2/20 | 0.46 |
| ▸ | PARP1 | P09874 | 2/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.43 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL2351583 | 0.92 | NPC1 (0.55) | NPC1LMNAPBKSMYD3HDAC4 | |
| Hydrochloric Acid SCHEMBL2352408 | 0.92 | NPC1 (0.55) | NPC1LMNAPBKSMYD3HDAC4 | |
| Hydrochloric Acid SCHEMBL2350435 | 0.92 | NPC1 (0.55) | NPC1LMNAPBKSMYD3HDAC4 | |
| Hydrochloric Acid SCHEMBL30265427 | 0.90 | NPC1 (0.65) | NPC1LMNAPBKMAPK1OPRK1 | |
| SCHEMBL3984993 | 0.88 | NPC1 (0.64) | NPC1LMNAMAPK1SMYD3HDAC6 | |
| Hydrochloric Acid SCHEMBL2356274 | 0.84 | NPC1 (0.60) | NPC1LMNASMYD3SUV39H1PRMT1 | |
| SCHEMBL8313317 | 0.83 | NPC1 (0.51) | NPC1LMNAPBKSMYD3HDAC6 | |
| Hydrochloric Acid SCHEMBL2350440 | 0.82 | NPC1 (0.67) | NPC1LMNASMYD3SUV39H1PRMT1 | |
| Hydrochloric Acid SCHEMBL30265463 | 0.82 | NPC1 (0.67) | NPC1LMNASMYD3SUV39H1PRMT1 | |
| SCHEMBL5797061 | 0.80 | ULK1 (0.40) | NPC1LMNAPBKHDAC6EPHX1 |
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-2011103018-A1 | SUBSTITUTED FUSED IMIDAZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF | HIGH POINT PHARMACEUTICALS, LLC (US) | 2011-08-25 | — | — | WO | disclosed |