Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCARB1 | Q8WTV0 | 5/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.34 |
| ▸ | ACLY | P53396 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.33 |
| ▸ | FABP4 | P15090 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4029927 | 0.88 | SCARB1 (0.43) | SCARB1HSD17B10ALDH1A1KDM4ENPC1 | |
| SCHEMBL4025431 | 0.88 | SCARB1 (0.46) | SCARB1HSD17B10ALDH1A1KDM4ENPC1 | |
| SCHEMBL4023327 | 0.83 | HSD17B10 (0.41) | SCARB1HSD17B10ALDH1A1KDM4ENPC1 | |
| SCHEMBL4204074 | 0.81 | ALDH1A1 (0.45) | SCARB1ALDH1A1KDM4EKMT2A | |
| SCHEMBL4031956 | 0.79 | THRB (0.42) | SCARB1HRH3 | |
| SCHEMBL4028396 | 0.78 | SCARB1 (0.66) | SCARB1HSD17B10NPC1HDAC1HDAC6 | |
| SCHEMBL13746785 | 0.77 | SCARB1 (0.38) | SCARB1HSD17B10ALDH1A1KDM4EKMT2A | |
| SCHEMBL13747863 | 0.76 | SCARB1 (0.46) | SCARB1HSD17B10ALDH1A1KDM4ENPC1 | |
| SCHEMBL6683721 | 0.72 | FABP4 (0.55) | HDAC1HDAC6FABP4 | |
| SCHEMBL2746850 | 0.70 | CNR2 (0.60) | — |
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-2009103022-A1 | DERIVATIVES OF SUBSTITUTED FUSED RING CYCLOINDOLES AND METHODS OF THEIR USE | ITHERX PHARMACEUTICALS, INC. (US) | 2009-08-20 | — | — | WO | disclosed |
| WO-2009103022-A1 | DERIVATIVES OF SUBSTITUTED FUSED RING CYCLOINDOLES AND METHODS OF THEIR USE | ITHERX PHARMACEUTICALS, INC. (US) | 2009-08-20 | — | — | WO | disclosed |