Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.37 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.37 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.37 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5082666 | 1.00 | ALDH1A1 (0.38) | ALDH1A1KDM4EHDAC3HDAC4HDAC1 | |
| Hydrochloric Acid SCHEMBL1251911 | 0.99 | ALDH1A1 (0.38) | ALDH1A1KDM4EHDAC3HDAC4HDAC1 | |
| Hydrochloric Acid SCHEMBL1251907 | 0.99 | ALDH1A1 (0.38) | ALDH1A1KDM4EHDAC3HDAC4HDAC1 | |
| SCHEMBL5079091 | 0.94 | HDAC3 (0.36) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL5079087 | 0.94 | HDAC3 (0.36) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| Hydrochloric Acid SCHEMBL1253084 | 0.93 | HDAC3 (0.35) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| Hydrochloric Acid SCHEMBL1253080 | 0.93 | HDAC3 (0.35) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL5076255 | 0.92 | SMN1; SMN2 (0.43) | ALDH1A1KDM4EMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL5076264 | 0.92 | SMN1; SMN2 (0.43) | ALDH1A1KDM4EMEN1KMT2ASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL1252192 | 0.91 | SMN1; SMN2 (0.43) | ALDH1A1KDM4EMEN1KMT2ASMN1; 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 |
|---|---|---|---|---|---|---|---|
| EP-1608377-B1 | PHARMACEUTICAL COMPOSITIONS COMPRISING INHIBITORS OF FAB I AND FURTHER ANTIBIOTICS | AFFINIUM PHARM INC (CA) | 2008-10-01 | — | — | EP | claimed |