Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | GRIN2D | O15399 | 3/20 | 0.37 |
| ▸ | GRIN3B | O60391 | 3/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 3/20 | 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL21519644 | 0.93 | MAPT (0.49) | MAPTRAB9ANPC1SMN1; SMN2CYP1A2 | |
| SCHEMBL15874799 | 0.90 | MAPT (0.52) | MAPTRAB9ANPC1SMN1; SMN2CYP1A2 | |
| SCHEMBL15874801 | 0.90 | MAPT (0.52) | MAPTRAB9ANPC1SMN1; SMN2CYP1A2 | |
| SCHEMBL21519612 | 0.83 | KMT2A (0.45) | MAPTRAB9ASMN1; SMN2CYP1A2CYP2C19 | |
| Acetic Acid SCHEMBL21519528 | 0.83 | MAPT (0.46) | MAPTRAB9ANPC1SMN1; SMN2CYP1A2 | |
| Acetic Acid SCHEMBL21519642 | 0.83 | MAPT (0.52) | MAPTRAB9ANPC1SMN1; SMN2CYP1A2 | |
| SCHEMBL17067844 | 0.81 | MAPT (0.59) | MAPTRAB9ANPC1SMN1; SMN2CYP1A2 | |
| SCHEMBL30275295 | 0.81 | HTT (0.39) | MAPTSMN1; SMN2CYP1A2CYP2C19HPGD | |
| SCHEMBL29498959 | 0.80 | NPC1 (0.51) | MAPTRAB9ANPC1SMN1; SMN2HPGD | |
| Acetic Acid SCHEMBL21519404 | 0.79 | CYP1A2 (0.54) | MAPTRAB9ANPC1SMN1; 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 |
|---|---|---|---|---|---|---|---|
| CN-107820518-B | Methods for selecting phosphatase selective inhibitors and non-selective phosphatase inhibitors | 英国研究与创新署 | 2023-04-21 | — | — | CN | disclosed |