Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHCR7 | Q9UBM7 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | ABCB1 | P08183 | 7/20 | 0.54 |
| ▸ | ABCC1 | P33527 | 3/20 | 0.54 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | ACACB | O00763 | 1/20 | 0.50 |
| ▸ | TNF | P01375 | 1/20 | 0.50 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.50 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | GMNN | O75496 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL10677884 | 0.86 | ABCB1 (0.56) | DHCR7KDM4ETDP1ABCB1ABCC1 | |
| SCHEMBL27645025 | 0.86 | DRD4 (0.56) | KDM4ETDP1ABCB1ABCC1ABCG2 | |
| SCHEMBL2098334 | 0.79 | ACACB (0.54) | KDM4EABCB1ABCC1ABCG2KMT2A | |
| SCHEMBL6962643 | 0.79 | ACACB (0.51) | KDM4EABCB1ABCC1ABCG2KMT2A | |
| SCHEMBL14234932 | 0.79 | TNF (0.67) | KDM4EKMT2ATNFNOD2NOD1 | |
| SCHEMBL30391046 | 0.79 | DHCR7 (0.67) | DHCR7KDM4EABCB1KMT2AMAPT | |
| SCHEMBL19032337 | 0.79 | DHCR7 (0.67) | DHCR7KDM4EABCB1KMT2AMAPT | |
| SCHEMBL3156676 | 0.76 | ACACB (0.51) | KDM4EABCB1ABCC1ABCG2KMT2A | |
| SCHEMBL3161336 | 0.76 | ACACB (0.57) | KDM4EABCB1ABCC1ABCG2KMT2A | |
| SCHEMBL14739580 | 0.76 | DHCR7 (1.00) | DHCR7KDM4ETDP1ABCB1ABCC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100386319-C | Tetra hydro iso quinoline compounds possessing anti breed and anti fungus activity and its salt | NO 2 UNIV OF MILITARY MEDICINE (CN) | 2008-05-07 | — | — | CN | disclosed |
| CN-1785978-A | Tetra hydro iso quinoline compounds possessing anti breed and anti fungus activity and its salt | NO 2 UNIV OF MILITARY MEDICINE (CN) | 2006-06-14 | — | — | CN | disclosed |