Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.42 |
| ▸ | KMO | O15229 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | GRN | P28799 | 1/20 | 0.40 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11714939 | 0.89 | AKR1C3 (0.41) | SRD5A2AKR1C3AKR1C2SLC6A4SLC6A3 | |
| SCHEMBL11716372 | 0.86 | ABCB11 (0.41) | AKR1C3AKR1C2TSHRABCB11PTGS2 | |
| SCHEMBL11711071 | 0.81 | SLC6A4 (0.44) | SRD5A2SLC6A4SLC6A3SLC6A2KMO | |
| SCHEMBL11720636 | 0.79 | SRD5A2 (0.42) | SRD5A2AKR1C3AKR1C2SLC6A4SLC6A3 | |
| SCHEMBL11718095 | 0.76 | AKR1C3 (0.40) | SRD5A2AKR1C3AKR1C2SLC6A4SLC6A3 | |
| SCHEMBL7684575 | 0.75 | PTGS2 (0.38) | AKR1C3AKR1C2SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL11712561 | 0.75 | PTGS2 (0.60) | SRD5A2SLC6A4SLC6A3SLC6A2KMO | |
| SCHEMBL11720761 | 0.73 | KMT2A (0.36) | AKR1C3AKR1C2SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL14192004 | 0.73 | AKR1C3 (0.64) | AKR1C3AKR1C2 | |
| SCHEMBL6017403 | 0.73 | AKR1C3 (0.64) | AKR1C3AKR1C2 |
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-4048191-A | Halo-substituted 1-loweralkyl-5-aroylpyrrole-2-acetic acid compounds | MCNEIL LABORATORIES, INCORPORATED (US) | 1977-09-13 | — | — | US | disclosed |