Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | PPIA | P62937 | 1/20 | 0.39 |
| ▸ | CASR | P41180 | 2/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | GMNN | O75496 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | FYN | P06241 | 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 | |
|---|---|---|---|---|
| SCHEMBL16527875 | 0.93 | GABRA1 (0.42) | ALDH1A1HPGDHSD17B10BCL2L1DPP4 | |
| SCHEMBL10679098 | 0.86 | GABRA1 (0.48) | DPP4TSHRCASRGABRA1GABRB2 | |
| SCHEMBL983104 | 0.86 | GABRA1 (0.48) | ALDH1A1HPGDHSD17B10BCL2L1DPP4 | |
| SCHEMBL2683682 | 0.83 | ALDH1A1 (0.56) | ALDH1A1HPGDHSD17B10BCL2L1SMN1; SMN2 | |
| SCHEMBL10424340 | 0.83 | GCGR (0.46) | ALDH1A1HPGDHSD17B10BCL2L1DPP4 | |
| SCHEMBL31243574 | 0.83 | TRPA1 (0.45) | ALDH1A1HPGDHSD17B10DPP4LMNA | |
| SCHEMBL323997 | 0.82 | ALDH1A1 (0.54) | ALDH1A1HPGDHSD17B10BCL2L1SMN1; SMN2 | |
| Ammonia Solution, Strong SCHEMBL324959 | 0.82 | ALDH1A1 (0.54) | ALDH1A1HPGDHSD17B10BCL2L1SMN1; SMN2 | |
| Water SCHEMBL28266485 | 0.82 | ALDH1A1 (0.54) | ALDH1A1HPGDHSD17B10BCL2L1SMN1; SMN2 | |
| SCHEMBL31243572 | 0.81 | TRPA1 (0.41) | ALDH1A1HPGDHSD17B10LMNATSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-102105439-B | Method for producing N-substituted carbamate and method for producing isocyanate using the N-substituted carbamate | ASAHI KASEI CHEMICALS CORP. (JP) | 2016-04-20 | — | — | CN | disclosed |