Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.61 |
| ▸ | GAA | P10253 | 4/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | TDP2 | O95551 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL3499327 | 0.87 | CA12 (0.57) | HPGDGAASRD5A2CA12CA1 | |
| SCHEMBL27672236 | 0.79 | HPGD (0.66) | HPGDGAAPKMTLR9ALDH1A1 | |
| SCHEMBL24321713 | 0.78 | HPGD (0.65) | HPGDGAAPKMTLR9ALDH1A1 | |
| SCHEMBL10398763 | 0.78 | HPGD (0.65) | HPGDGAAPKMTLR9ALDH1A1 | |
| SCHEMBL9731119 | 0.78 | HPGD (0.65) | HPGDGAAPKMTLR9ALDH1A1 | |
| SCHEMBL10398760 | 0.78 | OPRK1 (0.65) | HPGDGAAPKMTLR9ALDH1A1 | |
| SCHEMBL24321716 | 0.77 | HPGD (0.63) | HPGDGAAPKMTLR9ALDH1A1 | |
| SCHEMBL143970 | 0.77 | HPGD (1.00) | HPGDGAAPKMTLR9ALDH1A1 | |
| SCHEMBL31422646 | 0.77 | HPGD (1.00) | HPGDGAAPKMTLR9ALDH1A1 | |
| SCHEMBL11037624 | 0.77 | HPGD (0.58) | HPGDGAAPKMTLR9SRD5A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104936944-A | Indole full ketone derivative used as tyrosine-kinase inhibitor | KBP BIOSCIENCES CO LTD | 2015-09-23 | — | — | CN | disclosed |