Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | HPGD | P15428 | 5/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | PDE2A | O00408 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.40 |
| ▸ | HTR3E | A5X5Y0 | 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 | |
|---|---|---|---|---|
| SCHEMBL17993460 | 0.87 | ALDH1A1 (0.56) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL17993477 | 0.80 | KDM4E (0.45) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL17993463 | 0.80 | KDM4E (0.65) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL17993457 | 0.79 | KDM4E (0.44) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL10041604 | 0.77 | KDM4E (0.47) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL17993488 | 0.76 | KDM4E (0.51) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL10732365 | 0.75 | AHR (0.61) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL20821420 | 0.75 | KDM4E (0.43) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL10023784 | 0.74 | KDM4E (0.43) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL13350117 | 0.74 | KDM4E (0.50) | ALDH1A1HPGDKMT2ASMN1; SMN2MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3054498-B1 | BISIMIDAZODIAZOCINES | IDEMITSU KOSAN CO (JP) | 2017-09-20 | — | — | EP | disclosed |
| WO-2016125110-A1 | BISIMIDAZOLODIAZOCINES | IDEMITSU KOSAN CO., LTD. (JP) | 2016-08-11 | — | — | WO | disclosed |
| EP-3054498-A1 | Bisimidazodiazocines | Idemitsu Kosan Co., Ltd. (JP) | 2016-08-10 | — | — | EP | disclosed |