Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Dodecane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.69 |
| ▸ | CA12 | O43570 | 2/20 | 0.69 |
| ▸ | CA9 | Q16790 | 2/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.69 |
| ▸ | CA1 | P00915 | 1/20 | 0.69 |
| ▸ | CA2 | P00918 | 1/20 | 0.69 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.69 |
| ▸ | HPGD | P15428 | 1/20 | 0.69 |
| ▸ | CA4 | P22748 | 1/20 | 0.69 |
| ▸ | CA6 | P23280 | 1/20 | 0.69 |
| ▸ | CA7 | P43166 | 1/20 | 0.69 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.69 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.69 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.69 |
| ▸ | NAAA | Q02083 | 1/20 | 0.63 |
| ▸ | KAT8 | Q9H7Z6 | 4/20 | 0.58 |
| ▸ | PPARA | Q07869 | 2/20 | 0.58 |
| ▸ | BID | P55957 | 3/20 | 0.54 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.54 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| Hexadecane SCHEMBL28225619 | 1.00 | ALDH1A1 (0.69) | ALDH1A1CA12CA9KDM4ECA1 | |
| Salicylic Acid SCHEMBL28366261 | 1.00 | ALDH1A1 (0.69) | ALDH1A1CA12CA9KDM4ECA1 | |
| Salicylic Acid SCHEMBL8621859 | 0.98 | ALDH1A1 (0.72) | ALDH1A1CA12CA9KDM4ECA1 | |
| Salicylic Acid SCHEMBL294304 | 0.94 | ALDH1A1 (0.72) | ALDH1A1CA12CA9KDM4ECA1 | |
| Salicylic Acid SCHEMBL28066039 | 0.93 | ALDH1A1 (0.60) | ALDH1A1CA12CA9KDM4ECA1 | |
| Cetostearyl Alcohol SCHEMBL27785964 | 0.93 | ALDH1A1 (0.60) | ALDH1A1CA12CA9KDM4ECA1 | |
| Tridecan-1-Ol SCHEMBL28169604 | 0.93 | ALDH1A1 (0.60) | ALDH1A1CA12CA9KDM4ECA1 | |
| Myristyl Alcohol SCHEMBL27783736 | 0.93 | ALDH1A1 (0.60) | ALDH1A1CA12CA9KDM4ECA1 | |
| Salicylic Acid SCHEMBL27304495 | 0.93 | KDM4E (0.60) | ALDH1A1CA12CA9KDM4ECA1 | |
| Cetyl Alcohol SCHEMBL27940954 | 0.93 | ALDH1A1 (0.60) | ALDH1A1CA12CA9KDM4ECA1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109134765-A | A kind of polyisobutene and the graft copolymer of polyisoprene and preparation method thereof | 北京化工大学 | 2019-01-04 | — | — | CN | disclosed |
| CN-102531876-A | Preparation method for dodecane salicylic acid mixed rare earth compound | SHANGHAI BAOGANG INDUSTRY INSPECTION CO LTD | 2012-07-04 | — | — | CN | disclosed |
| CN-102531876-A | Preparation method for dodecane salicylic acid mixed rare earth compound | SHANGHAI BAOGANG INDUSTRY INSPECTION CO LTD | 2012-07-04 | — | — | CN | disclosed |
| WO-2004110876-A2 | CO2 GENERATING ABSORBENT PADS | CO2 TECHNOLOGIES, INC. (US) | 2004-12-23 | — | — | WO | disclosed |