Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | POLB | P06746 | 4/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 5/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 4/20 | 0.35 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.33 |
| ▸ | WNT3A | P56704 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL6938124 | 0.73 | NPSR1 (0.45) | ALDH1A1NPSR1MAPTPOLBPKM | |
| Fumaric Acid SCHEMBL6938117 | 0.73 | NPSR1 (0.45) | ALDH1A1NPSR1MAPTPOLBPKM | |
| SCHEMBL6938121 | 0.72 | ALDH1A1 (0.38) | ALDH1A1NPSR1MAPTPOLBPKM | |
| SCHEMBL6934230 | 0.70 | NPSR1 (0.43) | ALDH1A1NPSR1MAPTPOLBPKM | |
| Hydrochloric Acid SCHEMBL27509210 | 0.65 | MAPT (0.43) | ALDH1A1NPSR1MAPTPOLBPKM | |
| SCHEMBL6937191 | 0.62 | SLC6A2 (0.43) | MAPTMEN1KMT2AHTTCYP3A4 | |
| SCHEMBL6940949 | 0.62 | CHRM2 (0.41) | ALDH1A1NPSR1MAPTPOLBPKM | |
| SCHEMBL12475470 | 0.61 | ALDH1A1 (0.41) | ALDH1A1MAPTPOLBRECQLMEN1 | |
| SCHEMBL28095680 | 0.59 | PKM (0.43) | ALDH1A1NPSR1MAPTPOLBPKM | |
| Fumaric Acid SCHEMBL6940952 | 0.59 | POLB (0.43) | ALDH1A1NPSR1MAPTPOLBTSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1019358-A1 | NOVEL COMPOUNDS, THEIR USE AND PREPARATION | Pharmacia & Upjohn AB (SE) | 2000-07-19 | — | — | EP | disclosed |
| WO-1998043942-A1 | NOVEL COMPOUNDS, THEIR USE AND PREPARATION | PHARMACIA & UPJOHN AB (SE) | 1998-10-08 | — | — | WO | disclosed |