Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | HTT | P42858 | 3/20 | 0.58 |
| ▸ | ABCB1 | P08183 | 11/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8122448 | 0.78 | ABCB1 (0.75) | ABCB1 | |
| SCHEMBL9037038 | 0.76 | KMT2A (0.72) | ALDH1A1HTTABCB1TSHRKMT2A | |
| SCHEMBL8910031 | 0.74 | ABCB1 (0.63) | ABCB1 | |
| SCHEMBL15702583 | 0.73 | ADRB2 (0.72) | ALDH1A1HTTABCB1TSHRHSD17B10 | |
| SCHEMBL13033243 | 0.73 | SMN1; SMN2 (0.72) | ALDH1A1HTTTSHRHSD17B10KMT2A | |
| SCHEMBL8121398 | 0.72 | KCNH2 (0.76) | ABCB1 | |
| SCHEMBL2332160 | 0.70 | LMNA (0.73) | ALDH1A1HTTTSHRKMT2AMEN1 | |
| SCHEMBL18177902 | 0.70 | CYP2D6 (0.73) | ALDH1A1HTTABCB1KMT2AMEN1 | |
| SCHEMBL7291652 | 0.70 | KMT2A (0.59) | ALDH1A1HTTABCB1TSHRKMT2A | |
| Hydrochloric Acid SCHEMBL7300682 | 0.69 | LMNA (0.58) | ALDH1A1HTTABCB1TSHRKMT2A |
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-0691962-A1 | 1-AMINO-3-PHENOXY PROPANE DERIVATIVES AS MODULATORS OF MULTI-DRUG RESISTANCE | BASF AKTIENGESELLSCHAFT (DE) | 1996-01-17 | — | — | EP | disclosed |