Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | TAS1R3 | Q7RTX0 | 11/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 10/20 | 0.38 |
| ▸ | TAS1R2 | Q8TE23 | 10/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9608357 | 0.92 | TAS1R3 (0.41) | CYP3A4CYP1A2TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL18674532 | 0.86 | TAS1R3 (0.41) | CYP3A4CYP1A2TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL13125484 | 0.84 | TAS1R3 (0.44) | CYP3A4CYP1A2TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL6727338 | 0.83 | TAS1R3 (0.47) | CYP3A4CYP1A2TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL823811 | 0.79 | CES2 (0.42) | CYP3A4CYP1A2THRBMEN1HPGD | |
| SCHEMBL124392 | 0.79 | CES2 (0.42) | CYP3A4CYP1A2THRBMEN1HPGD | |
| SCHEMBL19360080 | 0.79 | CES2 (0.42) | CYP3A4CYP1A2THRBMEN1HPGD | |
| SCHEMBL19149846 | 0.78 | CYP3A4 (0.48) | CYP3A4CYP1A2HSD17B10BRD4BRPF1 | |
| SCHEMBL2011531 | 0.78 | MEN1 (0.46) | CYP1A2TAS1R3TAS1R1TAS1R2MEN1 | |
| SCHEMBL29042640 | 0.76 | CYP3A4 (0.39) | CYP3A4CYP1A2HSD17B10THRBMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0298020-B1 | USE OF AN EPOXIDATION REAGENT, AND PROCESS FOR THE PREPARATION OF 5-ALPHA (10-ALPHA) EPOXY-DELTA 9(11) STEROIDS | SCHERING AKTIENGESELLSCHAFT (DE) | 1992-06-24 | — | — | EP | disclosed |