Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.53 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | PHGDH | O43175 | 1/20 | 0.45 |
| ▸ | MGLL | Q99685 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11836941 | 1.00 | SIGMAR1 (0.53) | SIGMAR1FAAHPHGDHMGLLCA12 | |
| SCHEMBL23517155 | 0.83 | SIGMAR1 (0.53) | SIGMAR1FAAHPHGDHMGLLCA12 | |
| SCHEMBL11844957 | 0.81 | ALDH1A1 (0.44) | SIGMAR1ALDH1A1PLAU | |
| SCHEMBL11844974 | 0.81 | ALDH1A1 (0.44) | SIGMAR1ALDH1A1PLAU | |
| SCHEMBL11838683 | 0.79 | SIGMAR1 (0.42) | SIGMAR1LMNAALDH1A1HPGDPLAU | |
| SCHEMBL11836287 | 0.79 | SIGMAR1 (0.69) | SIGMAR1LMNA | |
| SCHEMBL11836298 | 0.79 | SIGMAR1 (0.69) | SIGMAR1LMNA | |
| SCHEMBL28784148 | 0.78 | SIGMAR1 (0.49) | SIGMAR1FAAHPHGDHMGLLCA12 | |
| SCHEMBL2481897 | 0.77 | ALDH1A1 (0.54) | SIGMAR1L3MBTL1ALDH1A1HPGDGFER | |
| SCHEMBL2481898 | 0.77 | ALDH1A1 (0.54) | SIGMAR1L3MBTL1ALDH1A1HPGDGFER |
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-3954995-A | Mono-and disubstituted hydroxyguanidines in the treatment of depression | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-05-04 | — | — | US | disclosed |
| US-3954995-A | Mono-and disubstituted hydroxyguanidines in the treatment of depression | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-05-04 | — | — | US | disclosed |