Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.94 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.94 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | XBP1 | P17861 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | RUNX1 | Q01196 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | CBFB | Q13951 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL80329 | 0.97 | ALDH1A1 (1.00) | ALDH1A1ALOX15NPSR1MEN1KMT2A | |
| SCHEMBL3916108 | 0.97 | ALDH1A1 (1.00) | ALDH1A1ALOX15NPSR1MEN1KMT2A | |
| Ammonia Solution, Strong SCHEMBL30606651 | 0.94 | ALDH1A1 (0.94) | ALDH1A1ALOX15NPSR1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL10866136 | 0.94 | ALDH1A1 (0.94) | ALDH1A1ALOX15NPSR1MEN1KMT2A | |
| SCHEMBL9292268 | 0.94 | ALDH1A1 (0.94) | ALDH1A1ALOX15NPSR1MEN1KMT2A | |
| Biphenyl SCHEMBL28348300 | 0.90 | ALDH1A1 (0.85) | ALDH1A1ALOX15NPSR1MEN1KMT2A | |
| SCHEMBL7565478 | 0.84 | ALDH1A1 (0.74) | ALDH1A1ALOX15NPSR1MEN1KMT2A | |
| SCHEMBL6263832 | 0.84 | ALDH1A1 (0.74) | ALDH1A1ALOX15NPSR1MEN1KMT2A | |
| SCHEMBL11414080 | 0.82 | ALDH1A1 (0.73) | ALDH1A1ALOX15MEN1KMT2AHTT | |
| SCHEMBL8834539 | 0.82 | ALDH1A1 (0.71) | ALDH1A1ALOX15NPSR1MEN1KMT2A |
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-4324913-A | REARRANGEMENT OF N-NITROSODIPHENYLAMINE, HYDROCHLORIC ACID, O-DICHLOROBENZENE SOLVENT | BAYER AKTIENGESELLSCHAFT (DE) | 1982-04-13 | — | — | US | disclosed |