Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | KIT | P10721 | 1/20 | 0.37 |
| ▸ | ABL2 | P42684 | 1/20 | 0.37 |
| ▸ | TGFBR1 | P36897 | 3/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | DRD4 | P21917 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 9/20 | 0.33 |
| ▸ | AKT2 | P31751 | 8/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.32 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.32 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.32 |
| ▸ | CLK2 | P49760 | 1/20 | 0.32 |
| ▸ | CLK3 | P49761 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3723604 | 0.88 | ABL1 (0.46) | ABL1KITABL2TGFBR1DRD2 | |
| SCHEMBL3725181 | 0.85 | AKT1 (0.40) | ABL1KITABL2AKT1AKT2 | |
| SCHEMBL3718092 | 0.83 | DRD2 (0.41) | ABL1KITABL2TGFBR1DRD2 | |
| SCHEMBL3801968 | 0.82 | AKT1 (0.39) | TGFBR1AKT1AKT2CYP2D6 | |
| SCHEMBL3716702 | 0.82 | DRD2 (0.40) | ABL1KITABL2TGFBR1DRD2 | |
| SCHEMBL3715980 | 0.82 | ACVR1 (0.41) | ABL1KITABL2TGFBR1DRD2 | |
| SCHEMBL3719755 | 0.78 | TBK1 (0.44) | MCHR1 | |
| SCHEMBL3725367 | 0.75 | DRD2 (0.41) | ABL1KITABL2TGFBR1DRD2 | |
| SCHEMBL3719903 | 0.73 | DRD2 (0.40) | TGFBR1DRD2DRD4DRD3 | |
| SCHEMBL3725755 | 0.73 | ABL1 (0.48) | ABL1KITABL2TGFBR1DRD2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2242742-B1 | PYRIDINE DERIVATIVES | NOVARTIS AG (CH) | 2015-12-02 | — | — | EP | disclosed |
| US-8343966-B2 | Organic compounds | NOVARTIS AG (CH) | 2013-01-01 | — | — | US | disclosed |
| EP-2242742-A2 | ORGANIC COMPOUNDS | Novartis AG (CH) | 2010-10-27 | — | — | EP | disclosed |
| WO-2009087212-A2 | PYRIDINE DERIVATIVES | NOVARTIS AG (CH) | 2009-07-16 | — | — | WO | disclosed |