Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 10/20 | 0.37 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.37 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | F2 | P00734 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL12803448 | 0.77 | HCAR2 (0.34) | ALDH1A1PIM3LMNA | |
| SCHEMBL3317344 | 0.76 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL28168679 | 0.76 | KDM4E (0.44) | ALDH1A1NPSR1MAP2K1NR4A2CREBBP | |
| SCHEMBL162657 | 0.76 | NPSR1 (0.41) | ALDH1A1NPSR1MAP2K1NR4A2CREBBP | |
| SCHEMBL6100678 | 0.76 | MAPK1 (0.43) | ALDH1A1NPSR1MAP2K1NR4A2CREBBP | |
| SCHEMBL31478620 | 0.74 | F2 (0.40) | ALDH1A1NPSR1MAP2K1NR4A2CREBBP | |
| SCHEMBL3706189 | 0.73 | KDM4E (0.42) | ALDH1A1NPSR1MAP2K1NR4A2CREBBP | |
| SCHEMBL24375889 | 0.71 | F2 (0.41) | ALDH1A1NPSR1MAP2K1NR4A2CREBBP | |
| SCHEMBL6975840 | 0.71 | NPSR1 (0.38) | ALDH1A1NPSR1MAP2K1NR4A2CREBBP | |
| SCHEMBL3658794 | 0.70 | NPSR1 (0.36) | ALDH1A1NPSR1MAP2K1NR4A2CREBBP |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |