Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.67 |
| ▸ | HPGD | P15428 | 9/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.62 |
| ▸ | RECQL | P46063 | 1/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.58 |
| ▸ | HTT | P42858 | 2/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL3761477 | 0.99 | NOD2 (0.66) | NOD2HPGDALDH1A1KDM4ERECQL | |
| SCHEMBL26804667 | 0.91 | NOD2 (0.79) | NOD2HPGDALDH1A1KDM4ERECQL | |
| SCHEMBL13691929 | 0.86 | NOD2 (0.67) | NOD2HPGDALDH1A1KDM4ERECQL | |
| SCHEMBL31114282 | 0.86 | NOD2 (0.85) | NOD2HPGDALDH1A1KDM4ERECQL | |
| SCHEMBL12227473 | 0.86 | ALDH1A1 (0.68) | NOD2HPGDALDH1A1KDM4ERECQL | |
| SCHEMBL14997043 | 0.86 | ALDH1A1 (0.68) | NOD2HPGDALDH1A1KDM4ERECQL | |
| SCHEMBL14424527 | 0.85 | KDM4E (0.73) | NOD2HPGDALDH1A1KDM4ERECQL | |
| SCHEMBL28287385 | 0.83 | HPGD (0.57) | NOD2HPGDALDH1A1KDM4ERECQL | |
| SCHEMBL2991933 | 0.83 | KCNA3 (0.61) | NOD2HPGDALDH1A1KDM4ERECQL | |
| SCHEMBL20420787 | 0.82 | KDM4E (0.69) | HPGDALDH1A1KDM4ELMNARAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-8168796-B2 | Fluorescent agent having ethynyl group | NIPPON CHEMICAL WORKS CO., LTD. (JP) | 2012-05-01 | — | — | US | disclosed |