Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 11/20 | 0.43 |
| ▸ | BRD2 | P25440 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | BRD3 | Q15059 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NSD3 | Q9BZ95 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10925887 | 0.85 | PTGS2 (0.51) | BRD4BRD2CYP1A2CYP2C9CYP3A4 | |
| SCHEMBL10926377 | 0.85 | CYP1A2 (0.38) | BRD4BRD2CYP1A2CYP2C9KCNH2 | |
| SCHEMBL10922513 | 0.74 | CSF1R (0.47) | BRD4CYP3A4ALDH1A1 | |
| SCHEMBL18529356 | 0.74 | BRD4 (0.44) | BRD4BRD2CYP1A2CYP2C9KCNH2 | |
| SCHEMBL10924753 | 0.73 | BRD4 (0.47) | BRD4BRD2CYP1A2CYP2C9KCNH2 | |
| SCHEMBL11039347 | 0.73 | BRD4 (0.34) | BRD4BRD2CYP1A2CYP2C9KCNH2 | |
| SCHEMBL10924680 | 0.72 | CYP3A4 (0.56) | BRD4BRD2CYP1A2CYP2C9KCNH2 | |
| SCHEMBL1653184 | 0.72 | ESR1 (0.60) | BRD4BRD2KCNH2HDAC1 | |
| SCHEMBL10958183 | 0.72 | PTGS2 (0.48) | BRD4BRD2CYP1A2CYP2C9CYP3A4 | |
| SCHEMBL10986559 | 0.70 | KCNH2 (0.44) | BRD4BRD2KCNH2HDAC1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-4536499-A | Isoxazolyl indolamines having anti-diabetic activity | SANDOZ, INC. (US) | 1985-08-20 | — | — | US | disclosed |