Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 1/20 | 0.46 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.39 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30108036 | 0.88 | PIM1 (0.46) | PIM1KDM4EALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL30107976 | 0.76 | ROCK1 (0.34) | HRH4KDM4EALDH1A1SMN1; SMN2SCN2A | |
| SCHEMBL30107951 | 0.75 | PTGS1 (0.46) | KDM4EALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL30108003 | 0.73 | MET (0.40) | HRH4ALDH1A1HTTGAANPSR1 | |
| SCHEMBL30108039 | 0.73 | ALDH1A1 (0.40) | KDM4EALDH1A1SMN1; SMN2HPGDMEN1 | |
| SCHEMBL30107975 | 0.72 | L3MBTL1 (0.40) | PIM1KDM4EALDH1A1SMN1; SMN2MEN1 | |
| Hydrochloric Acid SCHEMBL29769980 | 0.70 | FGFR1 (0.57) | PIM1KDM4EALDH1A1SMN1; SMN2LMNA | |
| Hydrochloric Acid SCHEMBL26907985 | 0.70 | FGFR1 (0.57) | PIM1KDM4EALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL31295948 | 0.68 | SCN2A (0.74) | HRH4KDM4ESCN2ACYP1A2CYP2C19 | |
| SCHEMBL30107966 | 0.68 | TSHR (0.40) | PIM1KDM4EALDH1A1SMN1; SMN2CYP1A2 |
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-2022203399-A1 | ADENOSINE A2A RECEPTOR ANTAGONIST AND USE THEREOF | 주식회사 스탠다임 | 2022-09-29 | — | — | WO | disclosed |