Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.40 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | PKM | P14618 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAP2K3 | P46734 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11279397 | 0.84 | ALDH1A1 (0.43) | ALDH1A1MAPTCES2CES1ALOX15 | |
| SCHEMBL11713185 | 0.80 | MAPT (0.46) | ALDH1A1MAPTCDK5CDK5R1GAA | |
| SCHEMBL28042622 | 0.73 | KEAP1 (0.42) | ALDH1A1MAPTMEN1KMT2APKM | |
| SCHEMBL6833172 | 0.73 | MAP2K3 (0.53) | ALDH1A1MEN1KMT2AMAP2K3HPGD | |
| SCHEMBL29664874 | 0.73 | MAPT (0.59) | ALDH1A1MAPTCES2CES1ALOX15 | |
| SCHEMBL5282720 | 0.73 | MAPT (0.59) | ALDH1A1MAPTCES2CES1ALOX15 | |
| SCHEMBL250099 | 0.72 | CES2 (0.71) | ALDH1A1MAPTCES2CES1ALOX15 | |
| SCHEMBL30293901 | 0.72 | CES2 (0.71) | ALDH1A1MAPTCES2CES1ALOX15 | |
| SCHEMBL2703087 | 0.71 | KEAP1 (0.59) | ALDH1A1MAPTCES2CES1ALOX15 | |
| SCHEMBL31574193 | 0.70 | CES2 (0.68) | ALDH1A1MAPTCES2CES1ALOX15 |
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-4012397-A | 2-Benzoyl-3-amino-pyridines | DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) | 1977-03-15 | — | — | US | disclosed |
| US-3969361-A | 2-Benzoyl-3-amino-pyridines | DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) | 1976-07-13 | — | — | US | disclosed |