Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 1/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.31 |
| ▸ | IDH1 | O75874 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.31 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5104033 | 1.00 | CHRNB4 (0.31) | CHRNB4CHRNA3IDH1SLC6A3HSD17B1 | |
| SCHEMBL8907704 | 0.85 | CCNB2 (0.32) | IDH1SLC6A3HSD17B1HSD17B2 | |
| SCHEMBL249200 | 0.72 | HSD17B1 (0.47) | CHRNB4CHRNA3HSD17B1HSD17B2 | |
| SCHEMBL5016512 | 0.70 | — | — | |
| SCHEMBL9559701 | 0.69 | SLC6A3 (0.30) | SLC6A3 | |
| SCHEMBL4411632 | 0.69 | HSD17B1 (0.43) | HSD17B1HSD17B2 | |
| SCHEMBL4411533 | 0.69 | HSD17B1 (0.43) | HSD17B1HSD17B2 | |
| SCHEMBL4412721 | 0.69 | HSD17B1 (0.43) | HSD17B1HSD17B2 | |
| SCHEMBL5104039 | 0.67 | CHRNB4 (0.38) | CHRNB4CHRNA3HSD17B1HSD17B2 | |
| SCHEMBL5100896 | 0.66 | CHRNB4 (0.38) | CHRNB4CHRNA3HSD17B1HSD17B2 |
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-0758331-A1 | POLYETHYLENE GLYCOL DERIVATISED DIHYDRO OR TETRAHYDRO PORPHYRINS, THEIR PREPARATION AND THEIR USE AS TUMOUR LOCALISING, PHOTOSENSITISING COMPOUNDS | SCOTIA HOLDINGS PLC (GB) | 1997-02-19 | — | — | EP | disclosed |
| WO-1995029915-A1 | POLYETHYLENE GLYCOL DERIVATISED DIHYDRO OR TETRAHYDRO PORPHYRINS, THEIR PREPARATION AND THEIR USE AS TUMOUR LOCALISING, PHOTOSENSITISING COMPOUNDS | SCOTIA HOLDINGS PLC (GB) | 1995-11-09 | — | — | WO | disclosed |