Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8664361 | 0.80 | HTR2A (0.52) | HTR2ACA1CA2TSHR | |
| SCHEMBL8587289 | 0.78 | HTR2A (0.42) | HTR2ACA1CA2EPHX2TSHR | |
| SCHEMBL28613357 | 0.70 | EDNRB (0.42) | HTR2ACA1CA2TSHR | |
| SCHEMBL7576966 | 0.65 | HTR2A (0.64) | HTR2ACA1CA2TSHR | |
| SCHEMBL5569765 | 0.65 | ACHE (0.33) | HTR2A | |
| SCHEMBL8719014 | 0.65 | HTR2A (0.39) | HTR2ACA1CA2 | |
| SCHEMBL9602938 | 0.65 | GPR3 (0.34) | HTR2A | |
| SCHEMBL6544747 | 0.65 | GPR3 (0.34) | HTR2A | |
| SCHEMBL7624908 | 0.63 | HTR2A (0.45) | HTR2ACA1CA2 | |
| SCHEMBL6545167 | 0.61 | MEN1 (0.33) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5744666-A | Process for preparing an alkynyl fulvene group containing compound and said compound | PHILLIPS PETROLEUM COMPANY (US) | 1998-04-28 | — | — | US | disclosed |
| US-5728908-A | Process for preparing a bridged ligand and said bridged ligand | PHILLIPS PETROLEUM COMPANY (US) | 1998-03-17 | — | — | US | disclosed |
| US-5631203-A | Metallocene compounds and preparation thereof containing terminal alkynes | PHILLIPS PETROLEUM COMPANY (US) | 1997-05-20 | — | — | US | disclosed |