Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
| ▸ | TNKS | O95271 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29976857 | 1.00 | ALDH1A1 (0.36) | ALDH1A1TSHRPOLBRXFP1NPC1 | |
| SCHEMBL23112507 | 0.93 | ALDH1A1 (0.35) | ALDH1A1TSHRPOLBRXFP1NPC1 | |
| SCHEMBL29977532 | 0.93 | GRIN2B (0.36) | ALDH1A1POLBRXFP1NPC1KDM4E | |
| SCHEMBL23112561 | 0.93 | GRIN2B (0.36) | ALDH1A1POLBRXFP1NPC1KDM4E | |
| SCHEMBL23112758 | 0.92 | ALDH1A1 (0.41) | ALDH1A1TSHRPOLBRXFP1NPC1 | |
| SCHEMBL23112957 | 0.91 | TEAD2 (0.36) | ALDH1A1POLBRXFP1NPC1KDM4E | |
| SCHEMBL29977529 | 0.90 | POLB (0.36) | ALDH1A1TSHRPOLBRXFP1NPC1 | |
| SCHEMBL23112276 | 0.90 | POLB (0.36) | ALDH1A1TSHRPOLBRXFP1NPC1 | |
| SCHEMBL23112506 | 0.89 | PDE2A (0.41) | ALDH1A1POLBRXFP1NPC1KDM4E | |
| SCHEMBL29977405 | 0.89 | PDE2A (0.41) | ALDH1A1POLBRXFP1NPC1KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3793559-A1 | SUBSTITUTED DIHYDROPYRAZOLO PYRAZINE CARBOXAMIDE DERIVATIVES | Bayer Aktiengesellschaft (DE) | 2021-03-24 | — | — | EP | disclosed |
| CN-112469412-A | Substituted dihydropyrazolopyrazine carboxamide derivatives | 拜耳公司 | 2021-03-09 | — | — | CN | disclosed |