Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.40 |
| ▸ | PTGER2 | P43116 | 2/20 | 0.40 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | APP | P05067 | 5/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5354456 | 1.00 | ALDH1A1 (0.41) | ALDH1A1KDM4EHPGDPTGER4PTGER2 | |
| SCHEMBL5362181 | 0.79 | MEN1 (0.42) | ALDH1A1KDM4EGAAMAPTPKM | |
| SCHEMBL5362177 | 0.79 | MEN1 (0.42) | ALDH1A1KDM4EGAAMAPTPKM | |
| SCHEMBL5369798 | 0.77 | SRD5A2 (0.43) | ALDH1A1KDM4EPTGER3PKMHDAC8 | |
| SCHEMBL5372569 | 0.77 | SRD5A2 (0.43) | ALDH1A1KDM4EPTGER3PKMHDAC8 | |
| SCHEMBL5363418 | 0.76 | CCR2 (0.49) | ALDH1A1KDM4EHPGDGAAMAPT | |
| SCHEMBL5359096 | 0.76 | CCR2 (0.49) | ALDH1A1KDM4EHPGDGAAMAPT | |
| SCHEMBL5427991 | 0.73 | CCR2 (0.43) | MAPTMTNR1AMTNR1B | |
| SCHEMBL5427985 | 0.73 | CCR2 (0.43) | MAPTMTNR1AMTNR1B | |
| SCHEMBL5350992 | 0.72 | MAPT (0.43) | ALDH1A1KDM4EGAAMAPTPKM |
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 |