Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.67 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.64 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.62 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.62 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.58 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1790854 | 0.85 | SLC7A5 (0.68) | SLC7A5LOXL2CYP4F2CYP4A11FOLH1 | |
| SCHEMBL27781443 | 0.84 | CYP4F2 (0.61) | SLC7A5CYP4F2CYP4A11ALDH1A1SMN1; SMN2 | |
| SCHEMBL13589439 | 0.84 | SLC7A5 (0.76) | SLC7A5LOXL2CYP4F2CYP4A11FOLH1 | |
| SCHEMBL28281252 | 0.84 | SLC7A5 (0.76) | SLC7A5LOXL2CYP4F2CYP4A11FOLH1 | |
| SCHEMBL15609287 | 0.84 | SLC7A5 (0.76) | SLC7A5LOXL2CYP4F2CYP4A11FOLH1 | |
| SCHEMBL20168566 | 0.84 | SLC7A5 (0.76) | SLC7A5LOXL2CYP4F2CYP4A11FOLH1 | |
| SCHEMBL31276630 | 0.83 | CYP4F2 (0.75) | SLC7A5LOXL2CYP4F2CYP4A11FOLH1 | |
| SCHEMBL40012 | 0.83 | CYP4F2 (0.75) | SLC7A5LOXL2CYP4F2CYP4A11FOLH1 | |
| SCHEMBL27575558 | 0.83 | SLC7A5 (0.58) | SLC7A5LOXL2CYP4F2CYP4A11FOLH1 | |
| SCHEMBL6687519 | 0.83 | SLC7A5 (0.69) | SLC7A5LOXL2CYP4F2CYP4A11FOLH1 |
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-101952254-B | Isoquinoline modulators of ATP-binding cassette transporters | VERTEX PHARMA | 2012-09-05 | — | — | CN | disclosed |
| CN-101952254-A | Isoquinoline modulators of ATP-binding cassette transporters | VERTEX PHARMA | 2011-01-19 | — | — | CN | disclosed |