Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.49 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.49 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | CLK1 | P49759 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9577607 | 1.00 | SLC6A2 (0.49) | SLC6A2SLC6A4SLC6A3CHRNA7CYP1A2 | |
| SCHEMBL9577610 | 0.86 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3CYP1A2RAB9A | |
| SCHEMBL9577613 | 0.86 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3CYP1A2RAB9A | |
| SCHEMBL11461426 | 0.86 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3CYP1A2RAB9A | |
| SCHEMBL5847603 | 0.70 | MTNR1A (0.54) | — | |
| SCHEMBL14711226 | 0.70 | TAS1R3 (0.51) | CHRNA7KMT2AALDH1A1MAPT | |
| SCHEMBL30940169 | 0.70 | TAS1R3 (0.51) | CHRNA7KMT2AALDH1A1MAPT | |
| SCHEMBL10740576 | 0.69 | CHRNA7 (0.43) | SLC6A2SLC6A4SLC6A3CHRNA7CYP1A2 | |
| SCHEMBL30515155 | 0.69 | RAB9A (0.51) | SLC6A2SLC6A4SLC6A3CYP1A2RAB9A | |
| SCHEMBL7946799 | 0.69 | HPGD (0.42) | SLC6A2SLC6A4SLC6A3CHRNA7CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0360351-B1 | PROCESS FOR THE PREPARATION OF CYCLOPENTENE, CYCLOPENTANE AND CYCLOHEXANE DERIVATIVES | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1993-04-28 | — | — | EP | disclosed |
| US-5136081-A | PROCESS FOR THE PREPARATION OF CYCLOPENTENE, CYCLOPENTANE AND CYCLOHEXANE DERIVATIVES | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1992-08-04 | — | — | US | disclosed |