Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | CASP3 | P42574 | 2/20 | 0.50 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.50 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.50 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL699731 | 0.82 | PIK3CA (0.38) | CYP19A1CA12CA1CA2CA9 | |
| SCHEMBL12756739 | 0.80 | CYP19A1 (0.58) | CYP19A1NPC1RAB9ACA12CA1 | |
| SCHEMBL694621 | 0.77 | CYP19A1 (0.62) | CYP19A1NPC1RAB9ACA12CA1 | |
| SCHEMBL4893046 | 0.76 | NPC1 (0.65) | CYP19A1NPC1RAB9ACA12CA1 | |
| SCHEMBL30047184 | 0.76 | NPC1 (0.65) | CYP19A1NPC1RAB9ACA12CA1 | |
| SCHEMBL5053299 | 0.75 | NPC1 (0.87) | CYP19A1NPC1RAB9ACA12CA1 | |
| SCHEMBL695292 | 0.73 | RAB9A (0.61) | CYP19A1NPC1RAB9ACA12CA1 | |
| SCHEMBL16102119 | 0.73 | NPC1 (0.62) | NPC1RAB9AKDM4EMAPTALDH1A1 | |
| SCHEMBL20852020 | 0.73 | CYP19A1 (0.61) | CYP19A1NPC1RAB9ACA12CA1 | |
| SCHEMBL28416625 | 0.73 | NPC1 (0.83) | CYP19A1NPC1RAB9ACA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2421825-A1 | AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS | Janssen Pharmaceutica N.V. (BE) | 2012-02-29 | — | — | EP | disclosed |
| WO-2010124108-A1 | AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS | JANSSEN PHARMACEUTICA NV (BE) | 2010-10-28 | — | — | WO | disclosed |