Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Carbon Monoxide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL7713754 | 0.86 | — | — | |
| Carbon Monoxide SCHEMBL2513859 | 0.68 | — | — | |
| Carbon Monoxide SCHEMBL3287009 | 0.68 | — | — | |
| Carbon Monoxide SCHEMBL2511643 | 0.68 | — | — | |
| Carbon Monoxide SCHEMBL2512316 | 0.68 | — | — | |
| Carbon Monoxide SCHEMBL2517295 | 0.68 | — | — | |
| Carbon Monoxide SCHEMBL2517309 | 0.68 | — | — | |
| Carbon Monoxide SCHEMBL888058 | 0.67 | — | — | |
| Carbon Monoxide SCHEMBL3290223 | 0.67 | — | — | |
| SCHEMBL8079535 | 0.65 | — | — |
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-1233968-A2 | TRANSITION METAL-CYCLOPENTADIENYL-TROPANE CONJUGATES | YALE UNIVERSITY (US) | 2002-08-28 | — | — | EP | disclosed |
| US-20020111486-A1 | Transition metal-cyclopentadienyl-tropane conjugates | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2002-08-15 | — | — | US | disclosed |
| WO-2001040239-A2 | TRANSITION METAL-CYCLOPENTADIENYL-TROPANE CONJUGATES | YALE UNIVERSITY (US) | 2001-06-07 | — | — | WO | disclosed |