Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.44 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.42 |
| ▸ | HTR3B | O95264 | 2/20 | 0.42 |
| ▸ | HTR3A | P46098 | 2/20 | 0.42 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.42 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | AMY1A | P0DUB6 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL929274 | 0.98 | ALDH1A1 (0.52) | ALDH1A1TUBB1TRPV4MAPTMEN1 | |
| SCHEMBL29958505 | 0.98 | ALDH1A1 (0.52) | ALDH1A1TUBB1TRPV4MAPTMEN1 | |
| SCHEMBL29198847 | 0.88 | TRPV4 (0.56) | ALDH1A1TUBB1TRPV4MAPTMEN1 | |
| SCHEMBL30467622 | 0.83 | SMN1; SMN2 (0.40) | ALDH1A1MAPTMEN1KMT2ACYP1A2 | |
| SCHEMBL28944660 | 0.81 | KDM4E (0.41) | ALDH1A1MAPTMEN1KMT2ACYP1A2 | |
| SCHEMBL29359707 | 0.80 | TRPV4 (0.50) | ALDH1A1TRPV4MAPTMEN1KMT2A | |
| SCHEMBL585492 | 0.80 | TRPV4 (0.50) | ALDH1A1TRPV4MAPTMEN1KMT2A | |
| Magnesium SCHEMBL30697198 | 0.78 | TRPV4 (0.48) | ALDH1A1TRPV4MAPTMEN1KMT2A | |
| SCHEMBL3893582 | 0.77 | CA2 (0.53) | ALDH1A1MAPTMEN1KMT2AHPGD | |
| SCHEMBL5634995 | 0.77 | CA12 (0.62) | ALDH1A1TUBB1MAPTMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3383839-A2 | PROCESS FOR THE PREPARATION OF N,N´-UNSUBSTITUTED CARBOXAMIDINES | AlzChem Trostberg GmbH (DE) | 2018-10-10 | — | — | EP | disclosed |