Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 4/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | PTGIR | P43119 | 5/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | CETP | P11597 | 2/20 | 0.34 |
| ▸ | PTGDR | Q13258 | 2/20 | 0.34 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.34 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.34 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.33 |
| ▸ | LIPE | Q05469 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL27659169 | 0.84 | HTR3E (0.41) | PARP1PTGIRCETPPTGDRLIPE | |
| SCHEMBL27659171 | 0.84 | CES2 (0.41) | CES2PKMMAOB | |
| SCHEMBL6505102 | 0.83 | CES1 (0.37) | KCNN4PARP1KMT2ACES1 | |
| SCHEMBL27659153 | 0.81 | PDK1 (0.37) | KCNN4KMT2A | |
| SCHEMBL28757754 | 0.74 | RXRA (0.38) | — | |
| SCHEMBL27659173 | 0.74 | KMT2A (0.34) | KMT2ACES2CES1 | |
| SCHEMBL28760313 | 0.74 | KIF11 (0.41) | KMT2ACES2CES1MAOB | |
| SCHEMBL28173074 | 0.71 | ALDH1A1 (0.43) | KMT2ACES1 | |
| SCHEMBL6486260 | 0.71 | PARP1 (0.50) | KCNN4PARP1KMT2ACES2CES1 | |
| SCHEMBL27659195 | 0.71 | PARP15 (0.39) | PARP10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005051381-A1 | Substituted urea-octatydroindols as antagonists of melanin concentrating hormone receptor 1 (MCH1R) | BIOVITRUM AB (SE) | 2005-06-09 | — | — | WO | claimed |