Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 6/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 6/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | MME | P08473 | 2/20 | 0.37 |
| ▸ | CCR1 | P32246 | 1/20 | 0.36 |
| ▸ | LDHA | P00338 | 1/20 | 0.36 |
| ▸ | FPR2 | P25090 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP3 | P08254 | 1/20 | 0.35 |
| ▸ | MMP7 | P09237 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL14899045 | 0.81 | AKR1C1 (0.48) | SLC6A4SLC6A3SLC6A2ALDH1A1SMN1; SMN2 | |
| SCHEMBL4249913 | 0.80 | SLC6A4 (0.58) | SLC6A4SLC6A3SLC6A2TP53CYP3A4 | |
| SCHEMBL16341922 | 0.80 | OPRM1 (0.38) | SLC6A4SLC6A3SLC6A2MMP1MMP2 | |
| SCHEMBL2328790 | 0.76 | SLC6A4 (0.35) | SLC6A4SLC6A3SLC6A2TP53CYP3A4 | |
| SCHEMBL2328791 | 0.76 | SLC6A4 (0.35) | SLC6A4SLC6A3SLC6A2TP53CYP3A4 | |
| SCHEMBL3542306 | 0.75 | SLC6A4 (0.40) | SLC6A4SLC6A3SLC6A2 | |
| SCHEMBL31649904 | 0.72 | CCR2 (0.36) | CCR1LDHAFPR2POLBMMP1 | |
| SCHEMBL27742158 | 0.70 | AKR1C1 (0.48) | SLC6A4SLC6A3SLC6A2ALDH1A1SMN1; SMN2 | |
| Acetic Acid SCHEMBL27970985 | 0.70 | OPRM1 (0.46) | SLC6A4SLC6A3SLC6A2CCR1POLB | |
| SCHEMBL9864275 | 0.70 | SLC6A4 (0.38) | SLC6A4SLC6A3SLC6A2CYP3A4ALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2356113-B1 | HETEROCYCLICALLY SUBSTITUTED ARYL COMPOUNDS AS HIF INHIBITORS | BAYER IP GMBH (DE) | 2015-01-07 | — | — | EP | disclosed |