Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | IDO1 | P14902 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28444990 | 0.87 | NPSR1 (0.41) | NPSR1ALDH1A1MAPTIDO1RAB9A | |
| SCHEMBL28436495 | 0.84 | NPSR1 (0.39) | NPSR1ALDH1A1IDO1KDM4ESMN1; SMN2 | |
| SCHEMBL28434283 | 0.84 | LMNA (0.50) | NPSR1ALDH1A1MAPTRAB9ANPC1 | |
| SCHEMBL28434286 | 0.77 | IDO1 (0.44) | NPSR1ALDH1A1MAPTIDO1RAB9A | |
| SCHEMBL28447761 | 0.77 | ALDH1A1 (0.38) | NPSR1ALDH1A1MAPTIDO1RAB9A | |
| SCHEMBL28443516 | 0.76 | RAB9A (0.48) | ALDH1A1MAPTIDO1RAB9AMEN1 | |
| SCHEMBL28439110 | 0.73 | ALDH1A1 (0.43) | NPSR1ALDH1A1MAPTIDO1RAB9A | |
| SCHEMBL28439164 | 0.71 | IDO1 (0.41) | NPSR1ALDH1A1MAPTIDO1RAB9A | |
| SCHEMBL15058993 | 0.71 | RECQL (0.43) | ALDH1A1MAPTRAB9ANPC1KDM4E | |
| SCHEMBL6433969 | 0.69 | MAPT (0.46) | ALDH1A1MAPTKDM4EMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-111153846-B | Pyrrole compound, preparation method thereof, pharmaceutical composition and application | CHINA PHARMACEUTICAL UNIVERSITY (CN) | 2021-08-31 | — | — | CN | disclosed |
| CN-111153846-A | Pyrrole compound, preparation method thereof, pharmaceutical composition and application | 中国药科大学 | 2020-05-15 | — | — | CN | disclosed |