Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | KIT | P10721 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL1583906 | 0.80 | GPR119 (0.43) | ALDH1A1KDM4ELMNAPOLBMEN1 | |
| SCHEMBL1583651 | 0.79 | CYP1A2 (0.41) | ADORA2BKITHPGDALDH1A1HTT | |
| SCHEMBL1583153 | 0.79 | ROCK2 (0.50) | KITHPGDALDH1A1KDM4ELMNA | |
| SCHEMBL3653187 | 0.78 | P2RX7 (0.52) | SMN1; SMN2ALDH1A1LMNATSHRP2RX4 | |
| SCHEMBL1583384 | 0.77 | KDM4E (0.48) | KITHPGDALDH1A1KDM4ELMNA | |
| SCHEMBL1663016 | 0.77 | P2RX7 (0.53) | HSD17B10KITALDH1A1TSHRP2RX4 | |
| SCHEMBL1583489 | 0.77 | SCN9A (0.51) | SMN1; SMN2ALDH1A1KDM4ELMNATSHR | |
| SCHEMBL1583535 | 0.76 | HRH3 (0.49) | CYP3A4HDAC2 | |
| SCHEMBL1583833 | 0.76 | TSHR (0.37) | HSD17B10KITHPGDALDH1A1HTT | |
| SCHEMBL1583149 | 0.76 | DPP4 (0.49) | HSD17B10ALDH1A1KDM4ENPSR1CYP3A4 |
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-2011041713-A2 | PIPERAZINYL ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2011-04-07 | — | — | WO | disclosed |