Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.52 |
| ▸ | HPGD | P15428 | 5/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | PGR | P06401 | 2/20 | 0.48 |
| ▸ | RORA | P35398 | 1/20 | 0.48 |
| ▸ | RORC | P51449 | 1/20 | 0.48 |
| ▸ | RORB | Q92753 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.45 |
| ▸ | HTR3B | O95264 | 2/20 | 0.45 |
| ▸ | HTR3A | P46098 | 2/20 | 0.45 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28973475 | 0.83 | KDM4E (0.68) | ALDH1A1KDM4EHPGDLMNAPOLB | |
| SCHEMBL10285545 | 0.81 | ALDH1A1 (0.50) | ALDH1A1KDM4EHPGDLMNAIMPDH2 | |
| SCHEMBL30807999 | 0.79 | KDM4E (0.66) | ALDH1A1KDM4EHPGDLMNAPOLB | |
| SCHEMBL7462175 | 0.78 | ALDH1A1 (0.83) | ALDH1A1KDM4EHPGDLMNAPOLB | |
| SCHEMBL9207881 | 0.78 | ALDH1A1 (0.56) | ALDH1A1KDM4EHPGDLMNAPOLB | |
| SCHEMBL28369352 | 0.76 | PIM1 (0.46) | ALDH1A1KDM4EHPGDLMNAPOLB | |
| SCHEMBL13849667 | 0.76 | CNR1 (0.46) | ALDH1A1KDM4EHPGDLMNAPOLB | |
| SCHEMBL96143 | 0.75 | MEN1 (0.56) | ALDH1A1KDM4ELMNAPOLBHSD17B10 | |
| SCHEMBL7434216 | 0.75 | KDM4E (0.64) | ALDH1A1KDM4EHPGDLMNAPOLB | |
| SCHEMBL9216894 | 0.75 | ALDH1A1 (0.52) | ALDH1A1KDM4EHPGDLMNAPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2468743-A1 | Nitrogen-containing bicyclic compounds useful as antibacterial agents | Toyama Chemical Co., Ltd. (JP) | 2012-06-27 | — | — | EP | disclosed |