Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | THRB | P10828 | 3/20 | 0.38 |
| ▸ | GSTO1 | P78417 | 4/20 | 0.38 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA3 | P07451 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL11682730 | 0.96 | ALDH1A1 (0.47) | ALDH1A1THRBGSTO1VCAM1L3MBTL1 | |
| SCHEMBL10692557 | 0.91 | ALDH1A1 (0.49) | ALDH1A1THRBGSTO1VCAM1L3MBTL1 | |
| SCHEMBL11521525 | 0.79 | ALDH1A1 (0.46) | ALDH1A1THRBGSTO1L3MBTL1HTR4 | |
| SCHEMBL11518719 | 0.77 | ALDH1A1 (0.43) | ALDH1A1HTR4CA12CA1CA2 | |
| SCHEMBL11681244 | 0.76 | ALDH1A1 (0.42) | ALDH1A1THRBVCAM1L3MBTL1CA12 | |
| SCHEMBL11516387 | 0.76 | ALDH1A1 (0.46) | ALDH1A1THRBL3MBTL1HTR4CA12 | |
| SCHEMBL3844818 | 0.74 | VCAM1 (0.46) | ALDH1A1THRBVCAM1KMT2ASMN1; SMN2 | |
| SCHEMBL11683847 | 0.74 | VCAM1 (0.43) | ALDH1A1THRBGSTO1VCAM1L3MBTL1 | |
| SCHEMBL11683784 | 0.74 | KMT2A (0.40) | ALDH1A1THRBGSTO1HTR4CYP3A4 | |
| SCHEMBL10687962 | 0.73 | ALDH1A1 (0.47) | ALDH1A1THRBVCAM1L3MBTL1CA12 |
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-4055557-A | MONOAZO DYES | BAYER AKTIENGESELLSCHAFT (DT) | 1977-10-25 | — | — | US | disclosed |