Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 6/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.59 |
| ▸ | LMNA | P02545 | 3/20 | 0.59 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.59 |
| ▸ | TSHR | P16473 | 3/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.59 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.59 |
| ▸ | HPGD | P15428 | 2/20 | 0.59 |
| ▸ | GLA | P06280 | 1/20 | 0.59 |
| ▸ | HTR2C | P28335 | 7/20 | 0.52 |
| ▸ | HTR1A | P08908 | 5/20 | 0.52 |
| ▸ | HTR2A | P28223 | 5/20 | 0.52 |
| ▸ | HTR2B | P41595 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | BLM | P54132 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | HTR7 | P34969 | 2/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL28422454 | 0.87 | NPSR1 (0.55) | NPSR1ALDH1A1LMNANFKB1TSHR | |
| SCHEMBL7292049 | 0.81 | NPSR1 (0.55) | NPSR1ALDH1A1LMNANFKB1TSHR | |
| SCHEMBL27959024 | 0.78 | NPSR1 (0.46) | NPSR1ALDH1A1LMNANFKB1TSHR | |
| SCHEMBL1667862 | 0.78 | NPSR1 (0.59) | NPSR1ALDH1A1LMNANFKB1TSHR | |
| SCHEMBL2494144 | 0.78 | HTR2C (0.52) | NPSR1ALDH1A1LMNANFKB1TSHR | |
| SCHEMBL5851184 | 0.78 | GPR84 (0.62) | NPSR1ALDH1A1LMNANFKB1TSHR | |
| SCHEMBL7292022 | 0.78 | HTR2C (0.56) | NPSR1ALDH1A1LMNANFKB1TSHR | |
| SCHEMBL9536748 | 0.78 | NPSR1 (0.56) | NPSR1ALDH1A1LMNANFKB1TSHR | |
| SCHEMBL7289716 | 0.77 | NPSR1 (0.47) | NPSR1ALDH1A1LMNANFKB1TSHR | |
| SCHEMBL7287906 | 0.76 | HTR1A (0.51) | ALDH1A1HPGDHTR1AHSD17B10HTR1D |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0991645-A1 | BIS-INDOLE DERIVATIVES HAVING ANTIMETASTATIC ACTIVITY, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Roche Diagnostics GmbH (DE) | 2000-04-12 | — | — | EP | claimed |
| WO-1999000381-A1 | BIS-INDOLE DERIVATIVES HAVING ANTIMETASTATIC ACTIVITY, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | ROCHE DIAGNOSTICS GMBH (DE) | 1999-01-07 | — | — | WO | claimed |
| EP-0887348-A1 | Bis-Indole derivatives having antimetastatic activity, a process for their preparation and pharmaceutical compositions containing them | Boehringer Mannheim Italia S.p.A. (IT) | 1998-12-30 | — | — | EP | claimed |
| EP-0887348-A1 | Bis-Indole derivatives having antimetastatic activity, a process for their preparation and pharmaceutical compositions containing them | Boehringer Mannheim Italia S.p.A. (IT) | 1998-12-30 | — | — | EP | disclosed |