Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.37 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6127908 | 0.75 | ALDH1A1 (0.43) | ALDH1A1PDE4DKMT2APDE4APDE4B | |
| SCHEMBL23808915 | 0.68 | KMT2A (0.63) | ALDH1A1KMT2ALMNAHTT | |
| SCHEMBL25422914 | 0.68 | TP53 (0.40) | ALDH1A1KMT2AMAPTHTT | |
| SCHEMBL2732129 | 0.68 | RAB9A (0.51) | ALDH1A1PDE4DKMT2AHDAC1MAPT | |
| SCHEMBL1430230 | 0.66 | KMT2A (0.55) | ALDH1A1PDE4DKMT2AHDAC1NLRP3 | |
| SCHEMBL20560667 | 0.66 | KMT2A (0.55) | ALDH1A1PDE4DKMT2ANLRP3NOX1 | |
| SCHEMBL13182376 | 0.66 | — | — | |
| SCHEMBL12283650 | 0.66 | — | — | |
| SCHEMBL10173395 | 0.66 | L3MBTL1 (0.40) | ALDH1A1KMT2AKDM4E | |
| SCHEMBL2732151 | 0.66 | ALDH1A1 (0.44) | ALDH1A1PDE4DKMT2AHDAC1NLRP3 |
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-2012056478-A1 | OXAZOLE AND ISOXAZOLE CRAC MODULATORS | LUPIN LIMITED (IN) | 2012-05-03 | — | — | WO | disclosed |