Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 19/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | THPO | P40225 | 1/20 | 0.46 |
| ▸ | MTOR | P42345 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18469383 | 0.83 | SIGMAR1 (0.49) | SIGMAR1TP53CYP2D6TSHRTHPO | |
| SCHEMBL17485887 | 0.83 | SIGMAR1 (0.51) | SIGMAR1TP53CYP2D6TSHRTHPO | |
| SCHEMBL129446 | 0.83 | SIGMAR1 (0.51) | SIGMAR1TSHRKMT2A | |
| SCHEMBL30966769 | 0.83 | SIGMAR1 (0.51) | SIGMAR1TSHRKMT2A | |
| SCHEMBL4487876 | 0.82 | SIGMAR1 (0.47) | SIGMAR1TP53CYP2D6TSHRTHPO | |
| SCHEMBL7258873 | 0.82 | NOS1 (0.50) | SIGMAR1TSHR | |
| Hydrochloric Acid SCHEMBL2867283 | 0.81 | SIGMAR1 (0.53) | SIGMAR1TSHRMEN1LMNAMAPT | |
| SCHEMBL25922215 | 0.81 | SIGMAR1 (0.50) | SIGMAR1TP53CYP2D6TSHRTHPO | |
| SCHEMBL18499750 | 0.79 | SIGMAR1 (0.53) | SIGMAR1TP53CYP2D6TSHRTHPO | |
| SCHEMBL7263645 | 0.79 | TAAR1 (0.58) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2212287-B1 | PIPERIDINYL AND PIPERAZINYL MODULATORS OF y-SECRETASE | JANSSEN PHARMACEUTICA NV (BE) | 2012-02-01 | — | — | EP | disclosed |
| US-4092308-A | 4-Sulphomethyl substituted hydroxypyridone azo dyestuffs | CIBA-GEIGY CORPORATION (US) | 1978-05-30 | — | — | US | disclosed |