Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KAT6A | Q92794 | 3/20 | 0.38 |
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.37 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.37 |
| ▸ | MDM4 | O15151 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | TYR | P14679 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27374431 | 0.88 | PTGS1 (0.32) | SMN1; SMN2MAPTCYP3A4KDM4EALDH1A1 | |
| SCHEMBL20037381 | 0.79 | HDAC8 (0.43) | SMN1; SMN2MAPTHDAC8ALDH1A1HPGD | |
| SCHEMBL24726649 | 0.77 | CES2 (0.30) | — | |
| SCHEMBL14525170 | 0.76 | TDP1 (0.35) | SMN1; SMN2MAPTCYP3A4HDAC8KDM4E | |
| SCHEMBL21666076 | 0.74 | GSK3B (0.42) | SMN1; SMN2KDM4EHTTHSD17B10 | |
| SCHEMBL22817438 | 0.74 | ALDH1A1 (0.33) | MAPTKDM4EALDH1A1HPGDHTT | |
| SCHEMBL20761356 | 0.73 | CFTR (0.31) | MAPTALDH1A1HTTTDP1LMNA | |
| SCHEMBL26013931 | 0.72 | RAB9A (0.36) | SMN1; SMN2MAPTCYP3A4KDM4ECA1 | |
| SCHEMBL11994349 | 0.71 | KAT6A (0.42) | KAT6ATP53BP1SMN1; SMN2MAPTCYP3A4 | |
| SCHEMBL19311812 | 0.71 | ALDH1A1 (0.38) | CYP3A4ALDH1A1ALOX15ALOX12HSD17B10 |
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-2022234965-A1 | HETEROARYL DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT | 주식회사 보로노이 | 2022-11-10 | — | — | WO | disclosed |