Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KRAS | P01116 | 1/20 | 0.47 |
| ▸ | NPY2R | P49146 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.44 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.44 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3688318 | 0.96 | NPY2R (0.46) | KRASNPY2RKDM4EMEN1ALDH1A1 | |
| SCHEMBL3683358 | 0.87 | FGFR1 (0.46) | NPY2RKDM4EMEN1ALDH1A1LMNA | |
| SCHEMBL3688840 | 0.85 | FGFR1 (0.45) | NPY2RKDM4EMEN1ALDH1A1LMNA | |
| SCHEMBL3694917 | 0.85 | LMNA (0.48) | NPY2RKDM4EMEN1ALDH1A1LMNA | |
| SCHEMBL3686603 | 0.85 | NR1H4 (0.47) | NPY2RKDM4EMEN1ALDH1A1LMNA | |
| SCHEMBL14280887 | 0.85 | LMNA (0.48) | NPY2RKDM4EMEN1ALDH1A1LMNA | |
| SCHEMBL3690909 | 0.85 | HDAC3 (0.53) | KDM4EMEN1ALDH1A1LMNACYP1A2 | |
| SCHEMBL3686108 | 0.84 | KRAS (0.45) | KRASNPY2RKDM4EMEN1ALDH1A1 | |
| SCHEMBL3696659 | 0.84 | KRAS (0.45) | KRASNPY2RKDM4EMEN1ALDH1A1 | |
| SCHEMBL3688449 | 0.84 | MAOB (0.55) | KDM4EMEN1ALDH1A1LMNACYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20060235073-A1 | Diamino-functional chalcones | LICA PHARMACEUTICALS A/S (DK) | 2006-10-19 | — | — | US | claimed |
| US-7642367-B2 | Diamino-functional chalcones | LICA PHARMACEUTICALS A/S (DK) | 2010-01-05 | — | — | US | disclosed |
| US-20060235073-A1 | Diamino-functional chalcones | LICA PHARMACEUTICALS A/S (DK) | 2006-10-19 | — | — | US | disclosed |