Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FBP1 | P09467 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7115702 | 1.00 | FBP1 (0.42) | FBP1RAB9AALDH1A1MAPTTSHR | |
| SCHEMBL10464713 | 0.82 | CA1 (0.43) | FBP1RAB9AALDH1A1MAPTKMT2A | |
| SCHEMBL11367654 | 0.82 | MAPT (0.59) | FBP1RAB9AALDH1A1MAPTKMT2A | |
| SCHEMBL10464714 | 0.82 | CA1 (0.43) | FBP1RAB9AALDH1A1MAPTKMT2A | |
| SCHEMBL11367648 | 0.82 | MAPT (0.59) | FBP1RAB9AALDH1A1MAPTKMT2A | |
| SCHEMBL18543740 | 0.81 | FBP1 (0.59) | FBP1RAB9AALDH1A1MAPTTSHR | |
| SCHEMBL10464733 | 0.78 | NFKB1 (0.46) | FBP1ALDH1A1MAPTKMT2AL3MBTL1 | |
| SCHEMBL10464732 | 0.78 | NFKB1 (0.46) | FBP1ALDH1A1MAPTKMT2AL3MBTL1 | |
| SCHEMBL11371872 | 0.78 | MAPT (0.38) | FBP1ALDH1A1MAPTKMT2AL3MBTL1 | |
| SCHEMBL7292016 | 0.77 | FBP1 (0.65) | FBP1ALDH1A1MAPTTSHRKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003014115-A1 | 3-SUBSTITUTED PYRROLO (2.1-A) ISOQUINOLINE DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 2003-02-20 | — | — | WO | disclosed |
| WO-2003014117-A1 | 3-SUBSTITUTED PYRROLO[2.1-A]ISOQUINOLINE DERIVATIVES | BAYER CORPORATION (US) | 2003-02-20 | — | — | WO | disclosed |