Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP1 | P53582 | 4/20 | 0.71 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.55 |
| ▸ | THRA | P10827 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL2125675 | 1.00 | METAP1 (0.71) | METAP1CYP19A1THRATHRBHTR1A | |
| Hydrochloric Acid SCHEMBL2125507 | 0.98 | METAP1 (0.72) | METAP1CYP19A1THRATHRB | |
| SCHEMBL3822940 | 0.91 | METAP1 (0.68) | METAP1CYP19A1SIGMAR1ACHE | |
| Hydrochloric Acid SCHEMBL2126669 | 0.89 | METAP1 (0.68) | METAP1SIGMAR1ACHE | |
| SCHEMBL8489825 | 0.84 | CYP19A1 (0.57) | METAP1CYP19A1HTR1ASIGMAR1ACHE | |
| SCHEMBL11635436 | 0.84 | CYP19A1 (0.52) | METAP1CYP19A1HTR1ASIGMAR1ACHE | |
| Hydrochloric Acid SCHEMBL7706188 | 0.84 | CYP19A1 (0.56) | METAP1CYP19A1HTR1ASIGMAR1ACHE | |
| SCHEMBL6630621 | 0.84 | METAP1 (0.51) | METAP1CYP19A1HTR1ASIGMAR1ACHE | |
| SCHEMBL2175676 | 0.83 | METAP1 (1.00) | METAP1CYP19A1ACHE | |
| SCHEMBL6630617 | 0.83 | METAP1 (0.50) | METAP1CYP19A1HTR1ASIGMAR1ACHE |
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 |
|---|---|---|---|---|---|---|---|
| US-6022895-A | Substituted amino compounds and their use as substances having an analgesic effect | GRUENENTHAL GMBH (DE) | 2000-02-08 | — | — | US | disclosed |