Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACKR3 | P25106 | 1/20 | 0.41 |
| ▸ | GLS | O94925 | 2/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | BRAF | P15056 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL4781496 | 0.98 | ACKR3 (0.40) | ACKR3GLSPLAUPOLBTNK2 | |
| SCHEMBL4783075 | 0.91 | PLAU (0.42) | ACKR3PLAUBRAF | |
| SCHEMBL4778219 | 0.90 | NAPEPLD (0.40) | ACKR3PLAUBRAFCYP1A2CYP2C19 | |
| SCHEMBL4782767 | 0.90 | CNR2 (0.42) | ACKR3GLSPLAUBRAFCYP1A2 | |
| SCHEMBL4783684 | 0.90 | ACKR3 (0.40) | ACKR3GLSPOLBATMALDH1A1 | |
| SCHEMBL4781500 | 0.89 | PLAU (0.41) | ACKR3PLAUBRAF | |
| SCHEMBL4936382 | 0.86 | HPGD (0.41) | ACKR3GLSPOLBATMALDH1A1 | |
| SCHEMBL4780823 | 0.86 | ACKR3 (0.39) | ACKR3GLSTNK2ATMALDH1A1 | |
| SCHEMBL4781359 | 0.84 | ACKR3 (0.47) | ACKR3PLAUBRAFGAA | |
| SCHEMBL4780831 | 0.84 | TNK2 (0.39) | ACKR3GLSTNK2ALDH1A1BRAF |
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-2008021388-A1 | HETEROARYL DERIVATIVES AS CYTOKINE INHIBITORS | KEMIA, INC. (US) | 2008-02-21 | — | — | WO | disclosed |