Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11688729 | 0.90 | ALDH1A1 (0.53) | ALDH1A1NPSR1MAPTCA1CA2 | |
| SCHEMBL11689696 | 0.89 | CA1 (0.60) | ALDH1A1NPSR1MAPTCA1CA2 | |
| SCHEMBL11684860 | 0.87 | ALDH1A1 (0.47) | ALDH1A1NPSR1MAPTCA1CA2 | |
| SCHEMBL11650278 | 0.81 | ALDH1A1 (0.58) | ALDH1A1NPSR1MAPTVCAM1SMN1; SMN2 | |
| SCHEMBL10693591 | 0.81 | ALDH1A1 (0.60) | ALDH1A1NPSR1MAPTCA1CA2 | |
| SCHEMBL11687653 | 0.79 | VCAM1 (0.52) | ALDH1A1NPSR1MAPTCA1CA2 | |
| SCHEMBL11444393 | 0.79 | CA1 (0.57) | ALDH1A1CA1CA2CA9VCAM1 | |
| SCHEMBL197477 | 0.79 | ALDH1A1 (0.54) | ALDH1A1NPSR1MAPTVCAM1SMN1; SMN2 | |
| SCHEMBL10695843 | 0.78 | TSHR (0.54) | ALDH1A1NPSR1CA1CA2CA9 | |
| SCHEMBL5461567 | 0.77 | ALDH1A1 (0.65) | ALDH1A1NPSR1MAPTVCAM1SMN1; SMN2 |
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 |