Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD5 | P21918 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8425489 | 0.82 | ADRA2A (0.36) | ALDH1A1LMNAKMT2AADRA2AADRA2B | |
| SCHEMBL8425278 | 0.79 | P2RX7 (0.43) | ALDH1A1LMNAKMT2AADRA2AADRA2B | |
| SCHEMBL8425245 | 0.72 | ADRA1D (0.39) | ALDH1A1LMNAKMT2AADRA2AADRA2B | |
| SCHEMBL6159052 | 0.70 | TACR2 (0.56) | SLC6A2SLC6A4SLC6A3OPRM1 | |
| SCHEMBL8425248 | 0.69 | TACR3 (0.40) | ADRA2AADRA2BADRA2CADRA1DADRA1A | |
| SCHEMBL8966890 | 0.64 | ALDH1A1 (0.46) | ALDH1A1LMNAKMT2AOPRM1TSHR | |
| SCHEMBL8592989 | 0.62 | TACR2 (0.48) | SLC6A2SLC6A4SLC6A3DRD2DRD1 | |
| SCHEMBL1502315 | 0.61 | CYP11B1 (0.57) | CYP11B1CYP11B2IDO1 | |
| SCHEMBL20617722 | 0.60 | OPRD1 (0.39) | ALDH1A1KMT2ACYP11B1CYP11B2IDO1 | |
| SCHEMBL593796 | 0.60 | CYP11B1 (0.58) | ALDH1A1CYP11B1CYP11B2IDO1TSHR |
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-5889024-A | Substituted heterocycles | ZENECA LIMITED (GB) | 1999-03-30 | — | — | US | disclosed |