Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | S1PR1 | P21453 | 4/20 | 0.58 |
| ▸ | THRA | P10827 | 3/20 | 0.57 |
| ▸ | THRB | P10828 | 3/20 | 0.57 |
| ▸ | SPHK1 | Q9NYA1 | 3/20 | 0.55 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.55 |
| ▸ | S1PR2 | O95136 | 2/20 | 0.55 |
| ▸ | RARB | P10826 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | RARA | P10276 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | MTOR | P42345 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | ESR1 | P03372 | 2/20 | 0.51 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.51 |
| ▸ | TACR2 | P21452 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL10956825 | 1.00 | ALDH1A1 (0.60) | ALDH1A1S1PR1THRATHRBSPHK1 | |
| SCHEMBL11428645 | 1.00 | ALDH1A1 (0.60) | ALDH1A1S1PR1THRATHRBSPHK1 | |
| SCHEMBL10951825 | 1.00 | ALDH1A1 (0.60) | ALDH1A1S1PR1THRATHRBSPHK1 | |
| SCHEMBL5513033 | 1.00 | ALDH1A1 (0.60) | ALDH1A1S1PR1THRATHRBSPHK1 | |
| SCHEMBL8633832 | 0.93 | ALDH1A1 (0.61) | ALDH1A1S1PR1THRATHRBRARB | |
| SCHEMBL10952675 | 0.86 | L3MBTL1 (0.50) | ALDH1A1THRBHSD17B10HPGDKDM4E | |
| SCHEMBL28033400 | 0.86 | SPHK1 (0.57) | THRATHRBSPHK1 | |
| SCHEMBL11072168 | 0.83 | PLK1 (0.49) | ALDH1A1S1PR1SLC6A3KDM4ELMNA | |
| Heptane SCHEMBL28185767 | 0.83 | EPHX1 (0.54) | ALDH1A1MEN1KMT2A | |
| SCHEMBL28369542 | 0.83 | RARB (0.65) | ALDH1A1THRATHRBSPHK1RARB |
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 |
|---|---|---|---|---|---|---|---|
| US-4492683-A | Method for inhibiting the growth of fungi with phenyl glycine compounds | BUFFALO COLOR CORPORATION (US) | 1985-01-08 | — | — | US | claimed |
| US-4492683-A | Method for inhibiting the growth of fungi with phenyl glycine compounds | BUFFALO COLOR CORPORATION (US) | 1985-01-08 | — | — | US | disclosed |