Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA7 | P43166 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17875279 | 1.00 | TSHR (0.52) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL6177152 | 0.91 | TSHR (0.44) | TSHRCA12CA1CA2CA7 | |
| Butyric Acid SCHEMBL9430242 | 0.90 | TSHR (0.42) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL7722451 | 0.86 | TSHR (0.52) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL30910849 | 0.83 | KMT2A (0.42) | TSHRKMT2AESR1ALDH1A1GAA | |
| SCHEMBL1928826 | 0.83 | KMT2A (0.42) | TSHRKMT2AESR1ALDH1A1GAA | |
| SCHEMBL28551398 | 0.82 | ZDHHC7 (0.46) | TSHRLMNAKMT2AALDH1A1MAPT | |
| SCHEMBL4071095 | 0.80 | TSHR (0.57) | TSHRGABRA1GABRB2LMNAALDH1A1 | |
| SCHEMBL6773227 | 0.80 | TSHR (0.57) | TSHRGABRA1GABRB2LMNAALDH1A1 | |
| SCHEMBL30483161 | 0.80 | TSHR (0.57) | TSHRGABRA1GABRB2LMNAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1994011378-A1 | ARYL THIOPYRANO[2,3,4-c,d]INDOLES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS | MERCK FROSST CANADA INC. (CA) | 1994-05-26 | — | — | WO | disclosed |
| US-5314900-A | Aryl thiopyrano[2,3,4-C,D]indoles as inhibitors of leukotriene biosynthesis | MERCK FROSST CANADA, INC. (CA) | 1994-05-24 | — | — | US | disclosed |