Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.46 |
| ▸ | IGF1R | P08069 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | FDPS | P14324 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | TNNC1 | P63316 | 5/20 | 0.41 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11635584 | 1.00 | KCNH2 (0.46) | KCNH2IGF1RALOX15FDPSALDH1A1 | |
| SCHEMBL11637834 | 0.85 | IGF1R (0.46) | IGF1RALOX15ALDH1A1CYP3A4TNNC1 | |
| SCHEMBL11640727 | 0.85 | IGF1R (0.46) | IGF1RALOX15ALDH1A1CYP3A4TNNC1 | |
| SCHEMBL11639315 | 0.83 | TNNC1 (0.41) | ALDH1A1CYP3A4TNNC1ESR1ADRA2A | |
| SCHEMBL11642561 | 0.83 | TNNC1 (0.41) | ALDH1A1CYP3A4TNNC1ESR1ADRA2A | |
| SCHEMBL11641629 | 0.83 | TNNC1 (0.41) | ALDH1A1CYP3A4TNNC1ESR1ADRA2A | |
| SCHEMBL11636057 | 0.83 | TNNC1 (0.41) | ALDH1A1CYP3A4TNNC1ESR1ADRA2A | |
| SCHEMBL11638625 | 0.83 | SIGMAR1 (0.46) | KCNH2FDPSL3MBTL1 | |
| SCHEMBL11639734 | 0.83 | SIGMAR1 (0.46) | KCNH2FDPSL3MBTL1 | |
| SCHEMBL11641479 | 0.83 | IGF1R (0.51) | IGF1RALOX15FDPSALDH1A1HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| US-4125714-A | Aryl substituted cycloalkanones | STERLING DRUG INC. (US) | 1978-11-14 | — | — | US | disclosed |
| US-4125541-A | Aryl substituted ketones | STERLING DRUG INC. (US) | 1978-11-14 | — | — | US | disclosed |