Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.51 |
| ▸ | BRPF1 | P55201 | 2/20 | 0.51 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.51 |
| ▸ | EP300 | Q09472 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | XBP1 | P17861 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27405249 | 0.86 | BRD4 (0.68) | BRD4BRPF1CREBBPEP300CYP1A2 | |
| SCHEMBL26422621 | 0.80 | BRD4 (0.42) | BRD4BRPF1CREBBPEP300CYP1A2 | |
| SCHEMBL1411774 | 0.74 | CYP1A2 (0.76) | BRD4BRPF1CREBBPCYP1A2CYP3A4 | |
| SCHEMBL4470793 | 0.71 | CYP1A2 (0.43) | CYP1A2NPSR1MAPTALDH1A1MAPK1 | |
| Butane SCHEMBL10872914 | 0.71 | ALDH1A1 (0.66) | BRD4BRPF1CREBBPCYP1A2CYP3A4 | |
| SCHEMBL16569542 | 0.70 | BRD4 (0.66) | BRD4BRPF1CREBBPEP300CYP1A2 | |
| SCHEMBL22137286 | 0.70 | ALDH1A1 (0.55) | BRD4BRPF1CREBBPEP300CYP1A2 | |
| SCHEMBL3285075 | 0.70 | NPSR1 (0.44) | BRD4BRPF1CREBBPEP300CYP1A2 | |
| SCHEMBL2150911 | 0.70 | CYP1A2 (0.57) | BRD4BRPF1CREBBPEP300CYP1A2 | |
| SCHEMBL26088690 | 0.69 | HPGD (0.51) | CYP1A2MAPTALDH1A1MAPK1SMN1; SMN2 |
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 |