Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLYCD | O95822 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.43 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | HSD17B2 | P37059 | 4/20 | 0.43 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | CDK4 | P11802 | 1/20 | 0.40 |
| ▸ | CCND1 | P24385 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL870352 | 0.94 | MLYCD (0.57) | MLYCDTDP1ALDH1A1LMNACES2 | |
| SCHEMBL9707103 | 0.86 | MLYCD (0.54) | MLYCDTDP1ALDH1A1LMNACES2 | |
| SCHEMBL4449884 | 0.85 | MAPT (0.56) | MLYCDALDH1A1LMNASMN1; SMN2HPGD | |
| SCHEMBL8816853 | 0.84 | HDAC1 (0.54) | MLYCDALDH1A1SMN1; SMN2HPGDHTT | |
| SCHEMBL13670740 | 0.84 | MEN1 (0.51) | MLYCDTDP1ALDH1A1LMNACES2 | |
| SCHEMBL5209405 | 0.81 | HDAC1 (0.46) | ATM | |
| SCHEMBL8312870 | 0.81 | MLYCD (0.49) | MLYCDTDP1ALDH1A1HSD17B2SMN1; SMN2 | |
| SCHEMBL16574187 | 0.80 | ALDH1A1 (0.55) | TDP1ALDH1A1LMNACES2CES1 | |
| SCHEMBL9154730 | 0.80 | MLYCD (0.48) | MLYCDALDH1A1CES2CES1HSD17B2 | |
| SCHEMBL8046453 | 0.80 | HRH3 (0.55) | MLYCDHSD17B2HSD17B1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0464465-B1 | Substituted aminoalkylbiphenyl derivatives, antimycotic composition containing them, and intermediates for their preparation | HOFFMANN LA ROCHE (CH) | 1995-01-11 | — | — | EP | disclosed |
| US-5239084-A | Chmical intermeidates for fungicides, mycosis | HOFFMANN-LA ROCHE INC. (US) | 1993-08-24 | — | — | US | disclosed |
| US-5177067-A | Fungicides | HOFFMANN-LAROCHE INC. (US) | 1993-01-05 | — | — | US | disclosed |
| EP-0464465-A1 | Substituted aminoalkylbiphenyl derivatives, antimycotic composition containing them, and intermediates for their preparation | F. HOFFMANN-LA ROCHE AG (CH) | 1992-01-08 | — | — | EP | disclosed |