Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.40 |
| ▸ | GSTM2 | P28161 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.39 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL18320296 | 0.79 | BRD4 (0.42) | BRD4GSTP1GSTM2L3MBTL1CXCR1 | |
| SCHEMBL21855932 | 0.79 | BRD4 (0.42) | BRD4GSTP1GSTM2L3MBTL1CXCR1 | |
| SCHEMBL15315500 | 0.74 | RAB9A (0.46) | CXCR1CXCR2ALDH1A1KMT2AMEN1 | |
| SCHEMBL22848181 | 0.73 | GSTP1 (0.40) | BRD4GSTP1GSTM2CXCR1CXCR2 | |
| SCHEMBL31399724 | 0.72 | PSMD14 (0.36) | BRD4GSTP1GSTM2CXCR1CXCR2 | |
| SCHEMBL10588609 | 0.71 | LMNA (0.47) | GSTP1GSTM2ALDH1A1KMT2AMEN1 | |
| SCHEMBL21855732 | 0.70 | GSTP1 (0.43) | BRD4GSTP1GSTM2CXCR1CXCR2 | |
| SCHEMBL29506065 | 0.70 | GSTP1 (0.43) | BRD4GSTP1GSTM2CXCR1CXCR2 | |
| SCHEMBL15611193 | 0.69 | BRD4 (0.47) | BRD4L3MBTL1ALDH1A1KMT2ARAB9A | |
| SCHEMBL2965820 | 0.69 | ALDH1A1 (0.49) | L3MBTL1ALDH1A1KMT2AMEN1RAB9A |
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-2020156243-A1 | SHP2 INHIBITOR AND APPLICATION THEREOF | 贝达药业股份有限公司 | 2020-08-06 | — | — | WO | disclosed |