Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2146806 | 1.00 | ALDH1A1 (0.55) | ALDH1A1L3MBTL1TDP1KDM4ETSHR | |
| SCHEMBL2148732 | 0.92 | LMNA (0.53) | ALDH1A1KDM4ECYP2C9SMN1; SMN2KMT2A | |
| SCHEMBL24323696 | 0.92 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1TDP1KDM4ETSHR | |
| SCHEMBL2148739 | 0.92 | LMNA (0.53) | ALDH1A1KDM4ECYP2C9SMN1; SMN2KMT2A | |
| SCHEMBL15362709 | 0.92 | ALDH1A1 (0.61) | ALDH1A1L3MBTL1TDP1KDM4ETSHR | |
| Hydrochloric Acid SCHEMBL2146368 | 0.91 | LMNA (0.52) | ALDH1A1KDM4ECYP2C9SMN1; SMN2KMT2A | |
| Hydrochloric Acid SCHEMBL2146359 | 0.91 | LMNA (0.52) | ALDH1A1KDM4ECYP2C9SMN1; SMN2KMT2A | |
| Hydrochloric Acid SCHEMBL15352721 | 0.90 | ALDH1A1 (0.60) | ALDH1A1L3MBTL1TDP1KDM4ETSHR | |
| Hydrochloric Acid SCHEMBL21640110 | 0.88 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1TDP1KDM4ETSHR | |
| SCHEMBL2146920 | 0.87 | ALOX15 (0.50) | ALDH1A1L3MBTL1TSHRSMN1; SMN2KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011088045-A1 | AURORA KINASE COMPOUNDS AND METHODS OF THEIR USE | AMBIT BIOSCIENCES CORPORATION (US) | 2011-07-21 | — | — | WO | disclosed |