Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.56 |
| ▸ | THRA | P10827 | 3/20 | 0.54 |
| ▸ | THRB | P10828 | 3/20 | 0.54 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9147259 | 0.86 | SIGMAR1 (0.67) | THRATHRBSIGMAR1KCNH2HDAC1 | |
| SCHEMBL9151024 | 0.86 | SIGMAR1 (0.67) | THRATHRBSIGMAR1KCNH2HDAC1 | |
| SCHEMBL9148170 | 0.86 | SIGMAR1 (0.67) | THRATHRBSIGMAR1KCNH2HDAC1 | |
| SCHEMBL9147658 | 0.86 | SIGMAR1 (0.67) | THRATHRBSIGMAR1KCNH2HDAC1 | |
| SCHEMBL9154254 | 0.85 | RAB9A (0.51) | BCL2L1THRATHRBGAASIGMAR1 | |
| SCHEMBL2277966 | 0.85 | SIGMAR1 (0.62) | BCL2L1SIGMAR1KCNH2TSHRL3MBTL1 | |
| SCHEMBL9146978 | 0.85 | TAAR1 (0.54) | THRATHRBSIGMAR1KCNH2L3MBTL1 | |
| SCHEMBL9152006 | 0.85 | TAAR1 (0.54) | THRATHRBSIGMAR1KCNH2POLB | |
| Hydrochloric Acid SCHEMBL9154562 | 0.84 | TAAR1 (0.53) | THRATHRBSIGMAR1KCNH2POLB | |
| SCHEMBL9151142 | 0.82 | SIGMAR1 (0.53) | BCL2L1THRATHRBSIGMAR1KCNH2 |
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-0401798-B1 | Substituted aminoalkylbenzene derivatives | HOFFMANN LA ROCHE (CH) | 1995-01-11 | — | — | EP | disclosed |
| US-5137920-A | METHOD OF TREATING FUNGAL INFECTIONS | HOFFMANN-LA ROCHE INC. (US) | 1992-08-11 | — | — | US | disclosed |