Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 4/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | SYK | P43405 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.32 |
| ▸ | HTR3B | O95264 | 1/20 | 0.32 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.32 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17193027 | 0.81 | ALDH1A1 (0.50) | BAZ2BKDM4ESRCESR1SMN1; SMN2 | |
| SCHEMBL14854341 | 0.76 | ADORA2A (0.50) | KDM4ESRCESR1ALDH1A1POLB | |
| SCHEMBL15680185 | 0.73 | NR4A2 (0.47) | KDM4ESMN1; SMN2ALDH1A1POLBMAPT | |
| SCHEMBL2844631 | 0.72 | KDM4E (0.46) | BAZ2BKDM4EHTR3ASYKALDH1A1 | |
| SCHEMBL23520038 | 0.71 | BAZ2B (0.45) | BAZ2BKDM4EHTR3ASYKSMN1; SMN2 | |
| SCHEMBL1417391 | 0.70 | KDM4E (0.70) | KDM4ESRCHTR3AALDH1A1POLB | |
| SCHEMBL15680403 | 0.70 | YTHDC1 (0.51) | KDM4ESRCSMN1; SMN2MAPK1KCNH2 | |
| SCHEMBL2845665 | 0.68 | ELANE (0.47) | KDM4EHTR3ASMN1; SMN2ALDH1A1POLB | |
| SCHEMBL17191900 | 0.67 | ALDH1A1 (0.47) | KDM4ESRCESR1SMN1; SMN2ALDH1A1 | |
| SCHEMBL14845174 | 0.66 | ALDH1A1 (0.49) | KDM4ESRCESR1ALDH1A1ADORA2A |
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-2013052568-A1 | ANTIBACTERIAL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2013-04-11 | — | — | WO | disclosed |