Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 2/20 | 0.61 |
| ▸ | NPC1 | O15118 | 4/20 | 0.57 |
| ▸ | RAB9A | P51151 | 4/20 | 0.57 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.57 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.51 |
| ▸ | ACACB | O00763 | 1/20 | 0.51 |
| ▸ | ACACA | Q13085 | 1/20 | 0.51 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.49 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11758978 | 0.99 | NPC1 (0.59) | CXCR4NPC1RAB9AHRH3PARP10 | |
| SCHEMBL11756062 | 0.96 | NPC1 (0.59) | CXCR4NPC1RAB9AHRH3PARP10 | |
| SCHEMBL11754575 | 0.93 | NPC1 (0.62) | NPC1RAB9AHRH3ALDH1A1SMN1; SMN2 | |
| SCHEMBL19381463 | 0.89 | HRH3 (0.57) | CXCR4NPC1RAB9AHRH3PARP10 | |
| SCHEMBL12656065 | 0.86 | HRH3 (0.55) | CXCR4NPC1RAB9AHRH3PARP10 | |
| SCHEMBL19381892 | 0.83 | PDE4A (0.62) | NPC1RAB9AHRH3PARP10ALDH1A1 | |
| SCHEMBL14161002 | 0.82 | PARP10 (0.61) | NPC1RAB9AHRH3PARP10ALDH1A1 | |
| SCHEMBL20805930 | 0.81 | FAAH (0.58) | NPC1RAB9AHRH3PARP10ALDH1A1 | |
| SCHEMBL21275528 | 0.80 | PARP10 (0.58) | NPC1RAB9APARP10ALDH1A1SMN1; SMN2 | |
| SCHEMBL19381465 | 0.80 | HSD17B10 (0.73) | NPC1RAB9AALDH1A1SMN1; SMN2LMNA |
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-4009208-A | N,N'-HEPTAMETHYLENEBIS(4-METHOXYBENZAMIDE) | STERLING DRUG INC. (US) | 1977-02-22 | — | — | US | disclosed |