Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TEC | P42680 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 4/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | NCF1 | P14598 | 1/20 | 0.49 |
| ▸ | APP | P05067 | 6/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | NQO1 | P15559 | 1/20 | 0.43 |
| ▸ | TERT | O14746 | 1/20 | 0.43 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.43 |
| ▸ | TUBB | P07437 | 1/20 | 0.43 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.43 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.43 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.43 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.43 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.43 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.43 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.43 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3271562 | 0.87 | MAOB (0.55) | TECMAOBNPC1RAB9ANCF1 | |
| SCHEMBL3403509 | 0.86 | TEC (0.52) | TECMAOBAPPALOX5MAPT | |
| SCHEMBL1550777 | 0.85 | ALOX5 (0.63) | TECMAOBNPC1RAB9AALOX5 | |
| SCHEMBL483893 | 0.83 | NCF1 (0.68) | NPC1RAB9ANCF1NQO1 | |
| Hydrochloric Acid SCHEMBL27511022 | 0.81 | NCF1 (0.66) | NPC1RAB9ANCF1NQO1 | |
| SCHEMBL20944583 | 0.81 | PDE2A (0.46) | MAOBNPC1RAB9AAPPTUBB4A | |
| SCHEMBL2323241 | 0.79 | KMT2A (0.54) | NPC1RAB9ANCF1NQO1MAPT | |
| SCHEMBL15595369 | 0.79 | APP (0.54) | MAOBNPC1RAB9AAPPTDP1 | |
| SCHEMBL13463408 | 0.78 | CYP3A4 (0.58) | MAOBNPC1RAB9AAPPTDP1 | |
| SCHEMBL18024052 | 0.78 | NCF1 (0.55) | NCF1APPTDP1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020119212-A1 | NITROIMIDAZOLE DERIVATIVE, PREPARATION AND USES THEREOF | 诺沃斯达药业有限公司 | 2020-06-18 | — | — | WO | disclosed |
| CN-110776492-A | Nitroimidazole derivative and preparation and application thereof | 诺沃斯达药业有限公司 | 2020-02-11 | — | — | CN | disclosed |