Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | THRA | P10827 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9705803 | 0.89 | NR1I2 (0.41) | NR1I2CYP3A4CYP2D6SMN1; SMN2ALDH1A1 | |
| SCHEMBL9705981 | 0.86 | HDAC6 (0.41) | NR1I2CYP3A4CYP2D6SMN1; SMN2ALDH1A1 | |
| SCHEMBL9863164 | 0.86 | NR1I2 (0.46) | NR1I2CYP3A4CYP2D6THRATHRB | |
| SCHEMBL9862942 | 0.85 | NR1I2 (0.40) | NR1I2CYP3A4CYP2D6SMN1; SMN2ALDH1A1 | |
| SCHEMBL9862957 | 0.85 | CYP3A4 (0.44) | NR1I2CYP3A4CYP2D6SMN1; SMN2POLB | |
| SCHEMBL9863026 | 0.84 | KMT2A (0.48) | SMN1; SMN2POLBKMT2AMEN1L3MBTL1 | |
| SCHEMBL9705732 | 0.82 | HDAC6 (0.41) | NR1I2CYP3A4CYP2D6SMN1; SMN2ALDH1A1 | |
| SCHEMBL9706267 | 0.82 | KDM4E (0.41) | NR1I2CYP3A4CYP2D6SMN1; SMN2ALDH1A1 | |
| SCHEMBL9705786 | 0.79 | ALDH1A1 (0.43) | NR1I2CYP3A4CYP2D6SMN1; SMN2ALDH1A1 | |
| SCHEMBL9706246 | 0.78 | HDAC6 (0.45) | SMN1; SMN2ALDH1A1POLBEGFRGAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5002960-A | Viricides for combating picornaviruses | STERLING DRUG, INC. (US) | 1991-03-26 | — | — | US | disclosed |
| US-4939267-A | Viricides | STERLING DRUG INC. (US) | 1990-07-03 | — | — | US | disclosed |
| US-4843087-A | OXAZOLINYL COMPOUNDS; RHINOVIRUSES AND PICORNAVIRUSES | STERLING DRUG INC. (US) | 1989-06-27 | — | — | US | disclosed |