Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 8/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 8/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 5/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.42 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3493490 | 0.82 | ALDH1A1 (0.58) | ALDH1A1TDP1CYP11B1CYP11B2GABRA1 | |
| SCHEMBL6809013 | 0.73 | CYP11B1 (0.52) | CYP11B1CYP11B2IDO1 | |
| SCHEMBL1271150 | 0.66 | TAAR1 (0.50) | ALDH1A1LMNAIDO1 | |
| SCHEMBL24966825 | 0.65 | ALDH1A1 (0.59) | ALDH1A1TDP1CYP11B1CYP11B2GABRA1 | |
| SCHEMBL21238502 | 0.65 | ALDH1A1 (0.62) | ALDH1A1TDP1CYP11B1CYP11B2GABRA1 | |
| SCHEMBL28264228 | 0.65 | SLC6A2 (0.40) | LMNACYP2C19MAPK1 | |
| SCHEMBL8943574 | 0.64 | IDO1 (0.47) | IDO1SMN1; SMN2 | |
| SCHEMBL14139039 | 0.64 | ALDH1A1 (0.61) | ALDH1A1TDP1CYP11B1CYP11B2GABRA1 | |
| SCHEMBL14098467 | 0.64 | ALDH1A1 (0.61) | ALDH1A1TDP1CYP11B1CYP11B2GABRA1 | |
| SCHEMBL1081228 | 0.62 | ALDH1A1 (1.00) | ALDH1A1TDP1CYP11B1CYP11B2GABRA1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6770647-B2 | Bicyclic hydroxamates as inhibitors of matrix metalloproteinases and/or TNF-α converting enzyme (TACE) | BRISTOL-MYERS SQUIBB PHARMA COMPANY | 2004-08-03 | — | — | US | disclosed |