Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 5/20 | 0.39 |
| ▸ | PGR | P06401 | 2/20 | 0.39 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.36 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.36 |
| ▸ | NQO1 | P15559 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3993767 | 0.86 | KIF11 (0.43) | ARPGRNQO1ALDH1A1CA1 | |
| SCHEMBL11258529 | 0.81 | ALDH1A1 (0.49) | ARALDH1A1CA1CA2MEN1 | |
| SCHEMBL10211859 | 0.80 | CA1 (0.50) | ALDH1A1CA1CA2MAPTCYP1A1 | |
| SCHEMBL7765888 | 0.79 | NQO1 (0.36) | ARPGRNQO1ALDH1A1CA1 | |
| SCHEMBL17162836 | 0.79 | MAPT (0.36) | ARPGRNQO1SMN1; SMN2NPSR1 | |
| SCHEMBL11708277 | 0.77 | CA12 (0.48) | ARALDH1A1CA1CA2KDM4E | |
| SCHEMBL29939130 | 0.77 | KIF11 (0.40) | ALDH1A1CA1CA2MEN1MAPT | |
| SCHEMBL3686783 | 0.76 | SLC6A4 (0.39) | ARPGRNQO1SMN1; SMN2NPSR1 | |
| SCHEMBL756255 | 0.76 | PTPN7 (0.50) | ARPGRMEN1KMT2APTPN7 | |
| SCHEMBL29775423 | 0.76 | PTPN7 (0.50) | ARPGRMEN1KMT2APTPN7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2671869-B1 | TETRAHYDROISOQUINOLINE DERIVATIVE | ASTELLAS PHARMA INC (JP) | 2015-11-04 | — | — | EP | disclosed |
| US-8962612-B2 | Tetrahydroisoquinoline derivative | ASTELLAS PHARMA INC. (JP) | 2015-02-24 | — | — | US | disclosed |
| US-8962612-B2 | Tetrahydroisoquinoline derivative | ASTELLAS PHARMA INC. (JP) | 2015-02-24 | — | — | US | disclosed |