Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.41 |
| ▸ | ABCC9 | O60706 | 2/20 | 0.37 |
| ▸ | ABCC8 | Q09428 | 2/20 | 0.37 |
| ▸ | KCNJ11 | Q14654 | 2/20 | 0.37 |
| ▸ | KCNJ8 | Q15842 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 4/20 | 0.35 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.35 |
| ▸ | CHRNG | P07510 | 1/20 | 0.35 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | CHRND | Q07001 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Benzoyl Chloride SCHEMBL8174205 | 0.84 | SLC6A3 (0.41) | HDAC1HDAC6NPC1RAB9ASLC6A3 | |
| Benzoyl Chloride SCHEMBL8174344 | 0.83 | RAB9A (0.36) | HDAC1HDAC6ABCC9ABCC8KCNJ11 | |
| Benzoyl Chloride SCHEMBL8166541 | 0.82 | SMN1; SMN2 (0.41) | NPC1RAB9ASMN1; SMN2CYP2C9MAPT | |
| Benzoyl Chloride SCHEMBL8179580 | 0.81 | NPC1 (0.42) | NPC1RAB9AALDH1A1SMN1; SMN2CYP2C9 | |
| Benzoyl Chloride SCHEMBL8173683 | 0.81 | HDAC1 (0.36) | HDAC1ABCC9ABCC8KCNJ11KCNJ8 | |
| Benzoyl Chloride SCHEMBL8166169 | 0.80 | ALDH1A1 (0.36) | ABCC9ABCC8KCNJ11KCNJ8NPC1 | |
| Benzoyl Chloride SCHEMBL8172701 | 0.80 | ALDH1A1 (0.57) | ABCC9ABCC8KCNJ11KCNJ8NPC1 | |
| Benzoyl Chloride SCHEMBL8165886 | 0.80 | NPC1 (0.47) | HDAC1HDAC6ABCC9ABCC8KCNJ11 | |
| Benzoyl Chloride SCHEMBL8167159 | 0.80 | ALDH1A1 (0.38) | NPC1RAB9AALOX15ALDH1A1KAT6A | |
| Benzoyl Chloride SCHEMBL8193019 | 0.80 | ABCC9 (0.40) | ABCC9ABCC8KCNJ11KCNJ8NPC1 |
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-6013836-A | PARTICULARLY ACTIVE AGAINST MOTHS AND BEETLES AND THEIR INSECT GROWTH REGULATING ACTIVITY WITHOUT ADVERSE IMPACT ON BENEFICIAL INSECTS; CROPS; FORESTRY | ROHM AND HAAS COMPANY (US) | 2000-01-11 | — | — | US | disclosed |