Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | PGK1 | P00558 | 1/20 | 0.37 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GALR2 | O43603 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 2/20 | 0.33 |
| ▸ | MMP9 | P14780 | 2/20 | 0.33 |
| ▸ | MMP8 | P22894 | 2/20 | 0.33 |
| ▸ | MMP13 | P45452 | 2/20 | 0.33 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 3/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL9305210 | 0.84 | ALDH1A1 (0.57) | ALDH1A1LMNAPGK1PIM3GAA | |
| SCHEMBL9306087 | 0.76 | ALDH1A1 (0.42) | ALDH1A1LMNAPGK1PIM3POLB | |
| SCHEMBL17385266 | 0.74 | ALDH1A1 (0.46) | ALDH1A1LMNAPGK1GAAKDM4E | |
| SCHEMBL10879283 | 0.74 | GAA (0.33) | ALDH1A1GAAKDM4ETDP1NPC1 | |
| SCHEMBL9307163 | 0.73 | GAA (0.41) | ALDH1A1LMNAPGK1PIM3GAA | |
| SCHEMBL9305007 | 0.73 | GAA (0.51) | ALDH1A1LMNAPGK1PIM3GAA | |
| SCHEMBL9306093 | 0.73 | ALDH1A1 (0.41) | ALDH1A1LMNAPGK1PIM3POLB | |
| SCHEMBL6497225 | 0.73 | LMNA (0.63) | ALDH1A1LMNAPGK1TDP1NPC1 | |
| SCHEMBL29250318 | 0.72 | SNCA (0.44) | ALDH1A1PIM3KDM4EPOLBTDP1 | |
| SCHEMBL9305016 | 0.70 | GAA (0.51) | ALDH1A1LMNAPGK1PIM3GAA |
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-5347008-A | Thio(cyclo) alkanepolycarboxylic acids containing heterocyclic substituents | CIBA-GEIGY CORPORATION (US) | 1994-09-13 | — | — | US | disclosed |
| EP-0129506-A2 | Heterocyclically substituted thio(cyclo)alkane polycarboxylic acids | CIBA-GEIGY AG (CH) | 1984-12-27 | — | — | EP | disclosed |