Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL12838360 | 0.76 | ALDH1A1 (0.71) | ALDH1A1POLBGAATDP1L3MBTL1 | |
| SCHEMBL15075637 | 0.76 | POLB (0.85) | ALDH1A1POLBGAAMEN1KMT2A | |
| SCHEMBL18040177 | 0.75 | NAPRT (0.53) | ALDH1A1POLBGAAMEN1KMT2A | |
| SCHEMBL2801582 | 0.75 | P2RX7 (0.53) | ALDH1A1KMT2ALMNAL3MBTL1NPC1 | |
| SCHEMBL17820014 | 0.74 | POLB (0.50) | ALDH1A1POLBGAAMEN1KMT2A | |
| SCHEMBL10072456 | 0.74 | POLB (0.50) | ALDH1A1POLBGAAMEN1KMT2A | |
| SCHEMBL19508074 | 0.74 | NPC1 (0.76) | ALDH1A1POLBGAALMNAL3MBTL1 | |
| O-Xylene SCHEMBL28193365 | 0.74 | MEN1 (0.53) | ALDH1A1POLBGAAMEN1KMT2A | |
| SCHEMBL12680191 | 0.73 | EGLN1 (0.50) | ALDH1A1POLBGAAMEN1KMT2A | |
| SCHEMBL15751480 | 0.73 | POLB (0.49) | ALDH1A1POLBGAAMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-7767670-B2 | Substituted 3-carboxamido isoxazoles as kinase modulators | AMBIT BIOSCIENCES CORPORATION (US) | 2010-08-03 | — | — | US | disclosed |