Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Methane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| Methane SCHEMBL6559545 | 0.85 | KDM1A (0.32) | KDM1ADRD2SLC6A4 | |
| Methane SCHEMBL6065039 | 0.84 | — | — | |
| Methane SCHEMBL7931270 | 0.76 | KDM1A (0.33) | KDM1ADRD2SLC6A4 | |
| Methane SCHEMBL5336355 | 0.74 | NPC1 (0.33) | — | |
| Methane SCHEMBL6558670 | 0.71 | HTR2C (0.30) | — | |
| Methane SCHEMBL6557742 | 0.71 | CHRM2 (0.32) | DRD2SLC6A4 | |
| Methane SCHEMBL7939292 | 0.70 | MTNR1A (0.32) | KDM1A | |
| Methane SCHEMBL7942791 | 0.70 | MEN1 (0.30) | KDM1A | |
| Methane SCHEMBL6557584 | 0.69 | NPC1 (0.32) | — | |
| Methane SCHEMBL6559495 | 0.69 | SLC6A2 (0.34) | KDM1ASLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0672675-B1 | Organometallic fluorenyl compounds, preparation, and use | PHILLIPS PETROLEUM CO (US) | 2002-07-24 | — | — | EP | disclosed |
| EP-0672675-A1 | Organometallic fluorenyl compounds, preparation, and use | PHILLIPS PETROLEUM COMPANY (US) | 1995-09-20 | — | — | EP | disclosed |
| US-5451649-A | Organometallic fluorenyl compounds, preparation, and use | PHILLIPS PETROLEUM COMPANY (US) | 1995-09-19 | — | — | US | disclosed |