Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 3/20 | 0.43 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.40 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | TNF | P01375 | 1/20 | 0.39 |
| ▸ | KCNA3 | P22001 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14387043 | 0.80 | KCNH2 (0.43) | KCNH2HPGDALDH1A1NPC1MEN1 | |
| SCHEMBL5365143 | 0.80 | ALDH1A1 (0.42) | KCNH2HPGDSMN1; SMN2ALDH1A1TSHR | |
| SCHEMBL5356702 | 0.77 | KCNH2 (0.40) | KCNH2ALDH1A1NPC1CYP3A4CYP2D6 | |
| SCHEMBL14386999 | 0.75 | AGTR1 (0.61) | CCR2AGTR1AGTR2PPARGALDH1A1 | |
| SCHEMBL8802854 | 0.72 | CCR2 (0.54) | CCR2TNFHPGDLMNASMN1; SMN2 | |
| SCHEMBL28437803 | 0.68 | KCNH2 (0.59) | KCNH2SMN1; SMN2MEN1TP53MAPK1 | |
| SCHEMBL3053983 | 0.68 | PDE4A (0.44) | KCNH2KCNA3HPGDLMNASMN1; SMN2 | |
| SCHEMBL6821030 | 0.67 | HDAC1 (0.62) | CCR2TNFHPGDLMNASMN1; SMN2 | |
| SCHEMBL30049411 | 0.67 | HDAC1 (0.62) | CCR2TNFHPGDLMNASMN1; SMN2 | |
| SCHEMBL4071200 | 0.66 | FFAR1 (0.58) | KCNH2ALDH1A1CYP1A2CYP3A4CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007134421-A1 | 2-VINYL INDOLES, PYRIDO AND AZEPINO INDOLE DERIVATIVES, 2-ALKYNYL INDOLES, 2-ALKYNYL BENZO[b]FURANS, THEIR PRECURSORS AND NOVEL PROCESSES FOR THE PREPARATION THEREOF | LAUTENS MARK (CA) | 2007-11-29 | — | — | WO | disclosed |