Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | DGKA | P23743 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | HTR1A | P08908 | 2/20 | 0.44 |
| ▸ | DRD2 | P14416 | 2/20 | 0.44 |
| ▸ | HTR2A | P28223 | 2/20 | 0.44 |
| ▸ | HTR2C | P28335 | 2/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.44 |
| ▸ | HRH1 | P35367 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8804186 | 0.90 | PKM (0.46) | PKMTDP1ALDH1A1LMNATP53 | |
| SCHEMBL8804471 | 0.89 | HTR2A (0.45) | PKMTDP1ALDH1A1LMNATP53 | |
| SCHEMBL8806540 | 0.89 | MAPT (0.47) | PKMTDP1ALDH1A1LMNATP53 | |
| SCHEMBL8804387 | 0.89 | PKM (0.51) | PKMTDP1ALDH1A1LMNATP53 | |
| SCHEMBL8805519 | 0.88 | TDP1 (0.52) | PKMTDP1ALDH1A1LMNATP53 | |
| SCHEMBL8804818 | 0.88 | MAPT (0.44) | PKMTDP1ALDH1A1LMNATP53 | |
| SCHEMBL8190364 | 0.88 | TDP1 (0.47) | PKMTDP1ALDH1A1LMNATP53 | |
| SCHEMBL8805082 | 0.86 | PKM (0.48) | PKMTDP1ALDH1A1LMNATP53 | |
| SCHEMBL8804273 | 0.85 | ADRA1A (0.44) | PKMLMNACYP2D6MAPTTSHR | |
| SCHEMBL8805551 | 0.84 | PKM (0.46) | PKMTDP1ALDH1A1LMNATP53 |
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-0647231-B1 | N-SUBSTITUTED 3-AZABICYCLO[3.2.0]HEPTANE DERIVATIVES USEFUL AS NEUROLEPTIC AGENTS, ETC. | BASF AG (DE) | 1997-08-27 | — | — | EP | disclosed |
| US-5475105-A | N-substituted azabicycloheptane derivatives | BASF AKTIENGESELLSCHAFT (DE) | 1995-12-12 | — | — | US | disclosed |