Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 9/20 | 0.56 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 6/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28406279 | 0.89 | MEN1 (0.53) | KMT2AEPHX2MEN1HPGDPOLB | |
| SCHEMBL28410644 | 0.88 | EPHX2 (0.55) | KMT2AEPHX2MEN1HPGDLMNA | |
| SCHEMBL28403250 | 0.88 | KMT2A (0.57) | KMT2AEPHX2MEN1NPC1RAB9A | |
| SCHEMBL28406359 | 0.87 | EPHX1 (0.66) | KMT2AEPHX2MEN1HPGDPOLB | |
| SCHEMBL28400723 | 0.87 | EPHX2 (0.58) | KMT2AEPHX2MEN1HPGDCYP2C19 | |
| SCHEMBL28402805 | 0.81 | CRBN (0.52) | EPHX2HPGDCYP2C19ALDH1A1EPHX1 | |
| SCHEMBL28403253 | 0.80 | LMNA (0.78) | KMT2AEPHX2MEN1SMN1; SMN2LMNA | |
| SCHEMBL28402766 | 0.79 | KMT2A (0.53) | KMT2AMEN1CYP2C19LMNAPOLB | |
| SCHEMBL28397948 | 0.79 | ALDH1A1 (0.65) | SMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL19480105 | 0.77 | NPC1 (0.65) | KMT2AMEN1NPC1RAB9ACYP1A2 |
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-108440389-B | 3,4, 5-trihydroxybenzoic acid derivative and preparation method and application thereof | 山东大学 | 2020-05-29 | — | — | CN | disclosed |