Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | ACP3 | P15309 | 2/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA5A | P35218 | 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 | |
|---|---|---|---|---|
| SCHEMBL563975 | 0.83 | POLB (0.47) | GPR84ALDH1A1HSD17B10HPGDBCL2L1 | |
| SCHEMBL1965079 | 0.83 | ALDH1A1 (0.44) | GPR84ALDH1A1HSD17B10HPGDBCL2L1 | |
| SCHEMBL14244855 | 0.83 | CYP2A6 (0.44) | GPR84ALDH1A1HSD17B10HPGDBCL2L1 | |
| SCHEMBL6003033 | 0.83 | CYP2A6 (0.44) | GPR84ALDH1A1HSD17B10HPGDBCL2L1 | |
| SCHEMBL1256220 | 0.79 | GPR84 (0.43) | GPR84ALDH1A1HSD17B10HPGDBCL2L1 | |
| SCHEMBL30729584 | 0.79 | ACP3 (0.47) | GPR84ALDH1A1HSD17B10HPGDBCL2L1 | |
| SCHEMBL28495219 | 0.79 | BCAT2 (0.44) | GPR84ALDH1A1HSD17B10HPGDBCL2L1 | |
| SCHEMBL11144673 | 0.78 | ALDH1A1 (0.42) | ALDH1A1HSD17B10HPGDBCL2L1CYP2A6 | |
| SCHEMBL29822328 | 0.78 | CA2 (0.46) | GPR84ALDH1A1HSD17B10HPGDBCL2L1 | |
| SCHEMBL3646058 | 0.78 | CA2 (0.46) | GPR84ALDH1A1HSD17B10HPGDBCL2L1 |
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-3980644-A | EXTRACTION WITH CYCLOHEXANONE | ELI LILLY AND COMPANY (US) | 1976-09-14 | — | — | US | disclosed |