Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.59 |
| ▸ | CASP1 | P29466 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | GSTA1 | P08263 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 6/20 | 0.51 |
| ▸ | HTT | P42858 | 5/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.50 |
| ▸ | MEN1 | O00255 | 5/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | GALR3 | O60755 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | PTGES | O14684 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30718412 | 0.82 | CA1 (0.49) | HPGDCYP2C9LMNAHTTALDH1A1 | |
| SCHEMBL30718449 | 0.82 | ALDH1A1 (0.53) | HPGDLMNAHTTALDH1A1SMN1; SMN2 | |
| SCHEMBL30718463 | 0.79 | HSP90AA1 (0.47) | HPGDCYP2C9CYP2C19LMNAHTT | |
| SCHEMBL30718410 | 0.78 | LIG1 (0.53) | HPGDCYP1A2ALOX15CYP2C19GSTA1 | |
| SCHEMBL15684683 | 0.76 | ALOX15 (1.00) | HPGDCYP1A2CYP2C9ALOX15CASP1 | |
| SCHEMBL7633062 | 0.74 | MAPT (0.69) | HPGDCYP1A2CYP2C9ALOX15CASP1 | |
| SCHEMBL11726606 | 0.74 | AKR1B1 (0.42) | LMNAALDH1A1 | |
| SCHEMBL31172946 | 0.74 | HPGD (0.71) | HPGDCYP1A2CYP2C9ALOX15CASP1 | |
| SCHEMBL145318 | 0.74 | HPGD (0.71) | HPGDCYP1A2CYP2C9ALOX15CASP1 | |
| SCHEMBL10864155 | 0.73 | KMT2A (0.44) | ALOX15CASP1ALDH1A1SMN1; SMN2MEN1 |
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-117285451-A | Polysubstituted pyrrole compound and synthetic method and application thereof | 重庆文理学院 | 2023-12-26 | — | — | CN | disclosed |