Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | AHR | P35869 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.41 |
| ▸ | FSCN1 | Q16658 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 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 | |
|---|---|---|---|---|
| SCHEMBL364764 | 0.80 | ALDH1A1 (0.65) | KMT2ANPC1POLBAHRRAB9A | |
| SCHEMBL3691064 | 0.79 | KMT2A (0.61) | KMT2ANPC1RAB9AALDH1A1MAPT | |
| SCHEMBL11785508 | 0.78 | KMT2A (0.47) | KMT2ANPC1POLBAHRRAB9A | |
| SCHEMBL3045049 | 0.77 | KMT2A (0.52) | KMT2ANPC1RAB9AALDH1A1MAPT | |
| SCHEMBL11785103 | 0.76 | KDM4E (0.60) | KMT2ANPC1RAB9AALDH1A1LMNA | |
| SCHEMBL6447800 | 0.76 | TTR (0.56) | KMT2ANPC1POLBRAB9AALDH1A1 | |
| SCHEMBL7861651 | 0.76 | KMT2A (0.55) | KMT2ANPC1RAB9AALDH1A1MAPT | |
| SCHEMBL220769 | 0.75 | KMT2A (0.57) | KMT2ANPC1POLBAHRRAB9A | |
| SCHEMBL17282266 | 0.75 | KMT2A (0.50) | KMT2ANPC1POLBRAB9AALDH1A1 | |
| SCHEMBL13446708 | 0.75 | NPC1 (0.54) | KMT2ANPC1RAB9AALDH1A1MAPT |
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-3956369-A | N-β-(2-acetyl-4-chlorophenoxy)-ethyl-N,N-dimethyl-N-benzyl-ammonium-p-chlorobenzene sulphonate, method for preparing same and medicinal preparation based thereon | OZERETSKOVSKAYA NATALIA NIKOLA | 1976-05-11 | — | — | US | disclosed |