Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | USP5 | P45974 | 1/20 | 0.36 |
| ▸ | FPR2 | P25090 | 1/20 | 0.35 |
| ▸ | PRNP | P04156 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | APAF1 | O14727 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | PPARA | Q07869 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | PDE5A | O76074 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30730193 | 0.81 | ALDH1A1 (0.34) | KDM4EALDH1A1KMT2AHPGDMAPT | |
| SCHEMBL16590485 | 0.79 | LMNA (0.46) | KDM4EALDH1A1KMT2AUSP5PRNP | |
| SCHEMBL569695 | 0.76 | — | — | |
| SCHEMBL11623533 | 0.74 | KMT2A (0.50) | KDM4EKMT2AUSP5POLBPTGS2 | |
| SCHEMBL23163078 | 0.73 | NPC1 (0.38) | KDM4EALDH1A1KMT2AUSP5RAB9A | |
| SCHEMBL21462908 | 0.73 | NPC1 (0.38) | KDM4EALDH1A1KMT2AUSP5RAB9A | |
| SCHEMBL21826394 | 0.73 | F2 (0.48) | KDM4EALDH1A1KMT2APOLBMAPT | |
| SCHEMBL21826382 | 0.73 | F2 (0.48) | KDM4EALDH1A1KMT2APOLBMAPT | |
| SCHEMBL29760265 | 0.73 | NPC1 (0.38) | KDM4EALDH1A1KMT2AUSP5RAB9A | |
| SCHEMBL23229674 | 0.70 | PGR (0.31) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8153626-B2 | Substituted diazepine sulfonamides as bombesin receptor subtype-3 modulators | MERCK SHARP & DOHME CORP. (US) | 2012-04-10 | — | — | US | disclosed |