Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | NPC1 | O15118 | 7/20 | 0.50 |
| ▸ | RAB9A | P51151 | 7/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | CCNE1 | P24864 | 5/20 | 0.45 |
| ▸ | CDK2 | P24941 | 5/20 | 0.45 |
| ▸ | CDK5 | Q00535 | 5/20 | 0.45 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.45 |
| ▸ | CDK1 | P06493 | 1/20 | 0.45 |
| ▸ | CDK4 | P11802 | 1/20 | 0.45 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.45 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.45 |
| ▸ | CCND1 | P24385 | 1/20 | 0.45 |
| ▸ | CDK7 | P50613 | 1/20 | 0.45 |
| ▸ | CDK9 | P50750 | 1/20 | 0.45 |
| ▸ | CCNH | P51946 | 1/20 | 0.45 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL12790160 | 0.81 | ALDH1A1 (0.46) | SMN1; SMN2ALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL2819462 | 0.81 | ALDH1A1 (0.47) | SMN1; SMN2ALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL27769540 | 0.81 | PDE2A (0.43) | SMN1; SMN2ALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL20558976 | 0.78 | NPC1 (0.44) | SMN1; SMN2ALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL2199263 | 0.78 | NPC1 (0.44) | SMN1; SMN2ALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL7040603 | 0.77 | ALDH1A1 (0.43) | SMN1; SMN2ALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL27688647 | 0.77 | KDM4E (0.43) | SMN1; SMN2ALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL10153257 | 0.75 | NPC1 (0.42) | SMN1; SMN2ALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL10191826 | 0.75 | ALDH1A1 (0.42) | SMN1; SMN2ALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL12788371 | 0.75 | NPC1 (0.46) | SMN1; SMN2ALDH1A1NPC1RAB9AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-1230166-C | Gyrase inhibitors and uses thereof | VERTEX PHARMA (US) | 2005-12-07 | — | — | CN | disclosed |
| CN-1400898-A | Gyrase inhibitors and uses thereof | VERTEX PHARMA (US) | 2003-03-05 | — | — | CN | disclosed |