Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 8/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.35 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.35 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9738536 | 0.89 | ALDH1A1 (0.39) | ALDH1A1USP2RAB9AHPGDTSHR | |
| SCHEMBL9737580 | 0.85 | SMN1; SMN2 (0.35) | ALDH1A1GAAUSP2RAB9AHPGD | |
| SCHEMBL9733242 | 0.83 | ALDH1A1 (0.39) | ALDH1A1GAAUSP2RAB9AHPGD | |
| SCHEMBL9735138 | 0.82 | KMT2A (0.40) | ALDH1A1GAARAB9ATSHRMEN1 | |
| SCHEMBL9739182 | 0.82 | ABCC9 (0.46) | CYP2C9CYP1A2CYP2D6CYP2C19TSHR | |
| SCHEMBL10757385 | 0.76 | ALDH1A1 (0.39) | ALDH1A1GAAUSP2RAB9AHPGD | |
| SCHEMBL9737735 | 0.76 | S100A4 (0.35) | ALDH1A1RAB9A | |
| SCHEMBL9144614 | 0.74 | ABCC9 (0.42) | ALDH1A1GAAUSP2HPGDCYP2C9 | |
| SCHEMBL9147423 | 0.74 | GAA (0.36) | ALDH1A1GAAUSP2RAB9AHPGD | |
| SCHEMBL9144578 | 0.74 | KMT2A (0.40) | ALDH1A1GAAUSP2RAB9AMAPT |
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-5143924-A | OXODIHYDROPYRIDYL CHROMAN DERIVATIVES | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1992-09-01 | — | — | US | disclosed |