Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 10/20 | 0.56 |
| ▸ | RAB9A | P51151 | 10/20 | 0.56 |
| ▸ | PKM | P14618 | 5/20 | 0.56 |
| ▸ | KLF5 | Q13887 | 2/20 | 0.56 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 3/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.49 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.49 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.49 |
| ▸ | HTR1F | P30939 | 2/20 | 0.46 |
| ▸ | HTR6 | P50406 | 2/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | HTR1D | P28221 | 1/20 | 0.45 |
| ▸ | HTR1B | P28222 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | HTR7 | P34969 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
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 SCHEMBL7996765 | 0.90 | MAOB (0.59) | NPC1RAB9APKMKLF5OPRK1 | |
| SCHEMBL7993421 | 0.81 | NPC1 (0.57) | NPC1RAB9APKMKLF5OPRK1 | |
| Hydrochloric Acid SCHEMBL8001822 | 0.80 | NPC1 (0.55) | NPC1RAB9AMAOBADORA2AADORA2B | |
| SCHEMBL7995053 | 0.73 | RAB9A (0.44) | NPC1RAB9APKMKLF5OPRK1 | |
| SCHEMBL11706816 | 0.72 | NPC1 (1.00) | NPC1RAB9APKMKLF5OPRK1 | |
| SCHEMBL3415541 | 0.72 | MAOB (0.50) | NPC1RAB9APKMKLF5OPRK1 | |
| SCHEMBL11703118 | 0.71 | MAOB (0.71) | NPC1RAB9APKMKLF5OPRK1 | |
| SCHEMBL6683837 | 0.70 | NPC1 (0.63) | NPC1RAB9APKMMAOBADORA2A | |
| SCHEMBL9728922 | 0.69 | NPC1 (0.70) | NPC1RAB9APKMKLF5OPRK1 | |
| SCHEMBL7993998 | 0.69 | NUDT1 (0.42) | ADORA2AADORA2BHTR6HTR1AHTR1D |
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-2001070705-A1 | 2-ACYLAMINOBENZIMIDAZOLE DERIVATIVES FOR TREATING GLAUCOMA | ALCON, INC. (CH) | 2001-09-27 | — | — | WO | disclosed |