Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NNMT | P40261 | 1/20 | 0.47 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.42 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.38 |
| ▸ | TUBB | P07437 | 1/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.38 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.38 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.38 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.38 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.38 |
| ▸ | TUBB8 | Q3ZCM7 | 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 | |
|---|---|---|---|---|
| SCHEMBL4530481 | 0.88 | NNMT (0.47) | NNMTMKNK1MKNK2CYP2A6KMT2A | |
| SCHEMBL14480182 | 0.86 | NNMT (0.46) | NNMTMKNK1MKNK2CYP2A6KMT2A | |
| SCHEMBL29977412 | 0.86 | NNMT (0.46) | NNMTMKNK1MKNK2CYP2A6KMT2A | |
| SCHEMBL29483219 | 0.86 | NNMT (0.46) | NNMTMKNK1MKNK2CYP2A6KMT2A | |
| SCHEMBL29514672 | 0.86 | NNMT (0.46) | NNMTMKNK1MKNK2CYP2A6KMT2A | |
| SCHEMBL16510139 | 0.86 | NNMT (0.46) | NNMTMKNK1MKNK2CYP2A6KMT2A | |
| SCHEMBL2568334 | 0.86 | NNMT (0.46) | NNMTMKNK1MKNK2CYP2A6KMT2A | |
| Hydrochloric Acid SCHEMBL23112628 | 0.84 | NNMT (0.44) | NNMTMKNK1MKNK2CYP2A6KMT2A | |
| Hydrochloric Acid SCHEMBL23112290 | 0.84 | NNMT (0.44) | NNMTMKNK1MKNK2CYP2A6KMT2A | |
| Hydrochloric Acid SCHEMBL23112629 | 0.84 | NNMT (0.44) | NNMTMKNK1MKNK2CYP2A6KMT2A |
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-1720856-A2 | HIV INTEGRASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-11-15 | — | — | EP | disclosed |
| WO-2005077050-A2 | HIV INTEGRASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2005-08-25 | — | — | WO | disclosed |