Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | POLA1 | P09884 | 2/20 | 0.36 |
| ▸ | RYR2 | Q92736 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6906401 | 1.00 | HSD11B1 (0.40) | HSD11B1POLBHSD17B10PTGS1AKR1C3 | |
| SCHEMBL31484123 | 1.00 | HSD11B1 (0.40) | HSD11B1POLBHSD17B10PTGS1AKR1C3 | |
| SCHEMBL11271707 | 0.90 | RYR2 (0.34) | HSD11B1HSD17B10PTGS1AKR1C3AKR1C2 | |
| SCHEMBL6909584 | 0.85 | ALDH1A1 (0.40) | HSD17B10ALDH1A1HPGDTSHRCYP1A2 | |
| SCHEMBL14303312 | 0.76 | HTR2C (0.38) | — | |
| SCHEMBL4966926 | 0.75 | HTR5A (0.40) | OPRM1 | |
| SCHEMBL9649135 | 0.69 | ALDH1A1 (0.40) | POLBHSD17B10ALDH1A1HPGDLMNA | |
| SCHEMBL6817230 | 0.68 | ALDH1A1 (0.43) | HSD11B1POLBHSD17B10PTGS1AKR1C3 | |
| SCHEMBL3431949 | 0.67 | POLA1 (0.49) | HSD17B10ALDH1A1HPGDTSHRPOLA1 | |
| SCHEMBL4247415 | 0.67 | PDE3B (0.43) | HSD11B1POLBHSD17B10PTGS1AKR1C3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-6016545-A | — | — | None | — | — | JP | disclosed |
| JP-61130217-A | — | — | None | — | — | JP | disclosed |
| JP-H0616545-A | ANTITUMOR AGENT CONTAINING ACETIC ACID DERIVATIVE | KUREHA CHEM IND CO LTD | 1994-01-25 | — | — | JP | disclosed |
| JP-S61130217-A | ANTITUMOR AGENT CONTAINING ACETIC ACID DERIVATIVE | KUREHA CHEM IND CO LTD | 1986-06-18 | — | — | JP | disclosed |