Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | PKM | P14618 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Formic Acid SCHEMBL28032861 | 0.79 | ALDH1A1 (0.39) | ALDH1A1RAB9AKMT2AMAPTPKM | |
| Ethoxycarbonyl Group SCHEMBL27323072 | 0.78 | CYP1A2 (0.43) | ALDH1A1KMT2AMAPTLMNAMEN1 | |
| SCHEMBL29421562 | 0.78 | — | — | |
| SCHEMBL306113 | 0.78 | — | — | |
| Ammonia Solution, Strong SCHEMBL28164484 | 0.76 | ALDH1A1 (0.40) | ALDH1A1RAB9AKMT2AMAPTPKM | |
| SCHEMBL3138385 | 0.76 | ALDH1A1 (0.40) | ALDH1A1RAB9AKMT2AMAPTPKM | |
| Fluoride SCHEMBL27656662 | 0.76 | ALDH1A1 (0.40) | ALDH1A1RAB9AKMT2AMAPTPKM | |
| Ethoxycarbonyl Group SCHEMBL27755003 | 0.74 | MAOB (0.42) | ALDH1A1MAPTLMNACYP1A2CYP2C9 | |
| Cyanide SCHEMBL28824673 | 0.73 | ALDH1A1 (0.37) | ALDH1A1RAB9AKMT2AMAPTPKM | |
| Ethoxycarbonyl Group SCHEMBL27852394 | 0.72 | HTR2A (0.40) | ALDH1A1RAB9AKMT2AMAPTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109923114-A | Pyrazolopyridine derivatives as HPK1 modulators and their use for the treatment of cancer | 因赛特公司 | 2019-06-21 | — | — | CN | disclosed |