Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.52 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.47 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | MPO | P05164 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 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 | |
|---|---|---|---|---|
| SCHEMBL9701892 | 0.86 | TAAR1 (0.44) | TAAR1CA2 | |
| SCHEMBL9701911 | 0.79 | TAAR1 (0.35) | TAAR1CA2KDM4E | |
| SCHEMBL9701941 | 0.79 | TYR (0.47) | TSHR | |
| SCHEMBL9702162 | 0.76 | TAAR1 (0.54) | TAAR1IDO1TSHR | |
| SCHEMBL9701924 | 0.75 | LOXL2 (0.43) | TAAR1AKR1B1 | |
| Hydrochloric Acid SCHEMBL11493475 | 0.73 | LOXL2 (0.41) | TAAR1AKR1B1 | |
| Ethylenediamine SCHEMBL3489186 | 0.71 | AKR1B1 (0.83) | TAAR1AKR1B1HSPA5IDO1KDM4E | |
| SCHEMBL28125524 | 0.71 | AKR1B1 (0.63) | TAAR1AKR1B1HSPA5IDO1MPO | |
| Ethylenediamine SCHEMBL513767 | 0.71 | AKR1B1 (0.83) | TAAR1AKR1B1HSPA5IDO1KDM4E | |
| SCHEMBL10535293 | 0.70 | AKR1B1 (0.56) | TAAR1AKR1B1HSPA5IDO1MPO |
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-5120764-A | Administering penicillamine and allenylamines to inhibit crosslinking of collagen | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-06-09 | — | — | US | disclosed |
| EP-0374440-A2 | Inhibitors of lysyl oxidase | MERRELL DOW PHARMACEUTICALS INC. (US) | 1990-06-27 | — | — | EP | disclosed |