Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | GSTO1 | P78417 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | F10 | P00742 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11597591 | 0.82 | PRMT1 (0.49) | ALDH1A1F10PRSS1PRSS2PRSS3 | |
| SCHEMBL11598316 | 0.82 | ALDH1A1 (0.48) | ALDH1A1CYP1A2CYP2C19TDP1MEN1 | |
| SCHEMBL11597707 | 0.82 | GSTO1 (0.47) | GSTO1ALDH1A1CYP1A2CYP2C19TDP1 | |
| SCHEMBL11555586 | 0.82 | GAA (0.50) | GAAGSTO1CA12CA9ALDH1A1 | |
| SCHEMBL11595503 | 0.82 | POLB (0.56) | GAAGSTO1CA12CA9ALDH1A1 | |
| SCHEMBL11595388 | 0.81 | GSTO1 (0.50) | GAAGSTO1CA12CA9ALDH1A1 | |
| SCHEMBL11527984 | 0.79 | GAA (0.47) | GAAGSTO1CA12CA9ALDH1A1 | |
| SCHEMBL11597183 | 0.79 | LMNA (0.51) | ALDH1A1TDP1KMT2ATP53POLB | |
| SCHEMBL11595395 | 0.77 | SMN1; SMN2 (0.53) | CA12CA9ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL11595506 | 0.76 | SMN1; SMN2 (0.66) | ALDH1A1CYP1A2CYP2C19CYP3A4TDP1 |
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-4125614-A | DIURETIC | HOECHST AKTIENGESELLSCHAFT (DE) | 1978-11-14 | — | — | US | disclosed |
| US-4061761-A | Thiazolidine derivatives | HOECHST AKTIENGESELLSCHAFT (DT) | 1977-12-06 | — | — | US | disclosed |