Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL10647510 | 0.90 | ALDH1A1 (0.46) | ALDH1A1NPSR1MAPTCYP3A4CYP2C9 | |
| SCHEMBL10556187 | 0.90 | MAPT (0.45) | ALDH1A1NPSR1MAPTCYP3A4CYP2C9 | |
| SCHEMBL10665931 | 0.85 | ALDH1A1 (0.48) | ALDH1A1NPSR1MAPTCYP3A4CYP2C9 | |
| SCHEMBL7426387 | 0.83 | ALDH1A1 (0.51) | ALDH1A1NPSR1MAPTCYP3A4CYP2C9 | |
| SCHEMBL10556386 | 0.79 | ALDH1A1 (0.50) | ALDH1A1NPSR1MAPTCYP3A4CYP2C9 | |
| SCHEMBL10649071 | 0.77 | ALDH1A1 (0.45) | ALDH1A1NPSR1MAPTCYP3A4CYP2C9 | |
| SCHEMBL9619258 | 0.77 | RAB9A (0.42) | ALDH1A1NPSR1MAPTCYP3A4CYP2C9 | |
| SCHEMBL10552491 | 0.76 | RAB9A (0.56) | ALDH1A1NPSR1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL10552931 | 0.76 | MAPT (0.44) | ALDH1A1NPSR1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL7439509 | 0.76 | RAB9A (0.67) | ALDH1A1NPSR1MAPTCYP3A4CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2262578-A | — | — | None | — | — | JP | disclosed |
| JP-H02262578-A | ISOINDOLINONE DERIVATIVE | TAKEDA CHEM IND LTD | 1990-10-25 | — | — | JP | disclosed |