Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.66 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.56 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.47 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.47 |
| ▸ | BACE1 | P56817 | 4/20 | 0.47 |
| ▸ | DHODH | Q02127 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11505491 | 0.97 | ALDH1A1 (0.69) | ALDH1A1L3MBTL1KMT2AMTNR1AMTNR1B | |
| SCHEMBL11689668 | 0.88 | PTGS2 (0.55) | ALDH1A1L3MBTL1KMT2AMTNR1AMTNR1B | |
| SCHEMBL11690361 | 0.86 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1KMT2AMTNR1AMTNR1B | |
| SCHEMBL27761990 | 0.81 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1KMT2AMTNR1AMTNR1B | |
| SCHEMBL27547723 | 0.81 | ALDH1A1 (0.58) | ALDH1A1L3MBTL1KMT2AMTNR1AMTNR1B | |
| SCHEMBL7811371 | 0.81 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1KMT2AMTNR1AMTNR1B | |
| SCHEMBL7487086 | 0.80 | ALDH1A1 (0.65) | ALDH1A1L3MBTL1KMT2AMTNR1AMTNR1B | |
| SCHEMBL11558486 | 0.80 | ALDH1A1 (0.65) | ALDH1A1L3MBTL1KMT2AMTNR1AMTNR1B | |
| SCHEMBL11655066 | 0.80 | ALDH1A1 (0.65) | ALDH1A1L3MBTL1KMT2AMTNR1AMTNR1B | |
| SCHEMBL11660383 | 0.80 | ALDH1A1 (0.65) | ALDH1A1L3MBTL1KMT2AMTNR1AMTNR1B |
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 |
|---|---|---|---|---|---|---|---|
| US-4026931-A | AZO DYES, FIBER-REACTIVE; INDOLE OR 5-AMINO-PYRAZOLE COUPLING COMPONENT | BAYER AKTIENGESELLSCHAFT (DT) | 1977-05-31 | — | — | US | disclosed |