Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.44 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.43 |
| ▸ | MGMT | P16455 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CTSV | O60911 | 1/20 | 0.40 |
| ▸ | CTSL | P07711 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12300713 | 0.84 | HTR1A (0.50) | NPC1RAB9AMEN1KMT2AHTR1A | |
| SCHEMBL4585380 | 0.83 | NPC1 (0.53) | NPC1RAB9AMEN1KMT2AHTR1A | |
| SCHEMBL8091636 | 0.82 | POLB (0.51) | NPC1RAB9AMEN1KMT2AHTR1A | |
| SCHEMBL27896267 | 0.81 | MAPT (0.47) | NPC1RAB9AMEN1KMT2AMGMT | |
| SCHEMBL1656075 | 0.81 | SMN1; SMN2 (0.53) | NPC1RAB9AMEN1KMT2AHTR1A | |
| SCHEMBL23748560 | 0.78 | CCNB2 (0.52) | NPC1RAB9AMEN1KMT2AHTR1A | |
| SCHEMBL27388637 | 0.78 | HTR1A (0.55) | NPC1RAB9AMEN1KMT2AHTR1A | |
| SCHEMBL27879445 | 0.77 | MAOB (0.45) | NPC1RAB9AMEN1KMT2AHTR1A | |
| SCHEMBL4883605 | 0.77 | BACE1 (0.53) | NPC1RAB9AMEN1KMT2ABACE1 | |
| SCHEMBL31053128 | 0.77 | BACE1 (0.61) | NPC1RAB9AMEN1KMT2ABACE1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102731488-A | Benzimidazole derivatives, preparation method thereof, pharmaceutical composition thereof and application thereof | INST MATERIA MEDICA CAMS | 2012-10-17 | — | — | CN | claimed |