Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL10779803 | 1.00 | ALDH1A1 (0.40) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A | |
| SCHEMBL10780234 | 1.00 | ALDH1A1 (0.40) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A | |
| SCHEMBL10783810 | 1.00 | ALDH1A1 (0.40) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL10779439 | 0.99 | TSHR (0.41) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL11116896 | 0.99 | TSHR (0.41) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A | |
| SCHEMBL10347861 | 0.78 | ALDH1A1 (0.45) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A | |
| SCHEMBL10651045 | 0.77 | TSHR (0.43) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A | |
| SCHEMBL9332294 | 0.77 | TSHR (0.43) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A | |
| SCHEMBL10658232 | 0.77 | TSHR (0.43) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A | |
| SCHEMBL9326737 | 0.77 | TSHR (0.45) | ALDH1A1TSHRSMN1; SMN2NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0109020-A2 | Derivatives from tricyclic amino acids, process for their preparation, compounds containing them and their use, as well as bicyclic amino acids as intermediates and process for their preparation | HOECHST AKTIENGESELLSCHAFT (DE) | 1984-05-23 | — | — | EP | disclosed |