Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | FABP4 | P15090 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | EDNRA | P25101 | 5/20 | 0.38 |
| ▸ | EDNRB | P24530 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7426960 | 0.94 | ALDH1A1 (0.51) | ALDH1A1HPGDKDM4EFABP4TSHR | |
| SCHEMBL7476678 | 0.91 | SLC22A12 (0.39) | ALDH1A1HPGDKDM4EFABP4TSHR | |
| SCHEMBL7474496 | 0.89 | MEN1 (0.43) | ALDH1A1HPGDKDM4ETSHRHSD17B10 | |
| SCHEMBL7421878 | 0.85 | KDM4E (0.41) | ALDH1A1HPGDKDM4EFABP4TSHR | |
| SCHEMBL7424979 | 0.83 | FABP4 (0.51) | ALDH1A1HPGDKDM4EFABP4TSHR | |
| SCHEMBL7420612 | 0.83 | ALDH1A1 (0.44) | ALDH1A1HPGDKDM4ETSHRHSD17B10 | |
| SCHEMBL7707720 | 0.82 | FABP4 (0.48) | ALDH1A1HPGDKDM4EFABP4SLC22A12 | |
| SCHEMBL7416251 | 0.78 | ALDH1A1 (0.54) | ALDH1A1HPGDKDM4EFABP4TSHR | |
| SCHEMBL7371603 | 0.75 | ALDH1A1 (0.58) | ALDH1A1HPGDKDM4EFABP4TSHR | |
| SCHEMBL7374915 | 0.75 | IP6K1 (0.39) | ALDH1A1HPGDKDM4EFABP4TSHR |
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-0820441-B1 | INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS | FUJISAWA PHARMACEUTICAL CO (JP) | 2002-06-26 | — | — | EP | disclosed |
| US-6358992-B1 | Method of inhibiting neoplastic cells with indole derivatives | CELL PATHWAYS, INC. | 2002-03-19 | — | — | US | disclosed |
| US-6069156-A | Indole derivatives as cGMP-PDE inhibitors | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2000-05-30 | — | — | US | disclosed |