Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Propane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 2/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALPL | P05186 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| Ethane SCHEMBL8632408 | 0.98 | DRD2 (0.32) | SLC6A4DRD2HTR2CPTPN1KDM4E | |
| Hexane SCHEMBL8633537 | 0.94 | CNR1 (0.34) | SLC6A4DRD2 | |
| Ethane SCHEMBL8632380 | 0.88 | CA12 (0.30) | — | |
| Ethane SCHEMBL8635883 | 0.87 | DRD2 (0.31) | SLC6A4DRD2 | |
| Propane SCHEMBL8630895 | 0.87 | CA12 (0.32) | SLC6A4HTR2CPTPN1KDM4EALPL | |
| Hexane SCHEMBL8633301 | 0.85 | CNR1 (0.34) | SLC6A4DRD2 | |
| Propane SCHEMBL8630709 | 0.84 | CHRNB2 (0.30) | — | |
| Hydrochloric Acid SCHEMBL4659081 | 0.84 | SLC6A4 (0.33) | SLC6A4DRD2HTR2CKDM4E | |
| Hydrochloric Acid SCHEMBL31126400 | 0.82 | SLC6A4 (0.32) | SLC6A4DRD2KDM4E | |
| Hydrochloric Acid SCHEMBL6903687 | 0.82 | SLC6A4 (0.32) | SLC6A4DRD2KDM4E |
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-5776851-A | COORDINATION POLYMERIZATION CATALYST | TARGOR GMBH (DE) | 1998-07-07 | — | — | US | claimed |
| US-5776851-A | COORDINATION POLYMERIZATION CATALYST | TARGOR GMBH (DE) | 1998-07-07 | — | — | US | disclosed |
| US-5693730-A | METALLOCENES HAVING MORE THAN ONE CENTRAL ATOM AND A SPECIAL BRIDGE STRUCTURE FOR PREPARING ISOTACTIC, HIGH-MOLECULAR-WEIGHT POLYMERS HAVING GOOD GRAIN MORPHOLOGY; PROPYLENE HOMO- AND COPOLYMERS | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-12-02 | — | — | US | disclosed |