Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | USP5 | P45974 | 1/20 | 0.30 |
| ▸ | TRPV6 | Q9H1D0 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14965582 | 0.87 | HSD17B10 (0.38) | CHRM1ALDH1A1KMT2AKCNH2LMNA | |
| SCHEMBL14966094 | 0.82 | PDE7A (0.33) | CHRM1 | |
| SCHEMBL14965938 | 0.81 | CHRM1 (0.34) | CHRM1KMT2AKCNH2 | |
| SCHEMBL14965838 | 0.81 | CHRM1 (0.34) | CHRM1KMT2AKCNH2 | |
| SCHEMBL14965829 | 0.79 | ALDH1A1 (0.39) | KDM4EALDH1A1LMNA | |
| SCHEMBL14965756 | 0.76 | PKM (0.40) | KDM4EALDH1A1LMNA | |
| SCHEMBL14965802 | 0.76 | L3MBTL3 (0.43) | KMT2ALMNA | |
| SCHEMBL14966168 | 0.75 | ALDH1A1 (0.40) | KDM4EALDH1A1KMT2ALMNA | |
| SCHEMBL14965832 | 0.75 | NPC1 (0.36) | ALOX15CHRM1ALDH1A1KMT2ALMNA | |
| SCHEMBL14965791 | 0.74 | KDM4E (0.36) | CHRM1KDM4EALDH1A1KMT2AKCNH2 |
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-2013072903-A1 | NITROIMIDAZOXADIAZOCINE COMPOUNDS | ITHEMBA PHARMACEUTICALS (PROPRIETARY) LIMITED (ZA) | 2013-05-23 | — | — | WO | claimed |
| WO-2013072903-A1 | NITROIMIDAZOXADIAZOCINE COMPOUNDS | ITHEMBA PHARMACEUTICALS (PROPRIETARY) LIMITED (ZA) | 2013-05-23 | — | — | WO | disclosed |