Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.45 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.45 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.44 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.44 |
| ▸ | RAD52 | P43351 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7823262 | 0.85 | TDP1 (0.47) | TSHRMEN1KMT2AALDH1A1LMNA | |
| SCHEMBL2045552 | 0.85 | GABRA1 (0.47) | MEN1KMT2AALDH1A1GABRA1GABRB2 | |
| SCHEMBL7832805 | 0.79 | TSHR (0.62) | TSHRMEN1KMT2AALDH1A1LMNA | |
| SCHEMBL6797118 | 0.76 | TSHR (0.60) | TSHRMEN1KMT2AALDH1A1LMNA | |
| SCHEMBL9023551 | 0.76 | CA12 (0.54) | TSHRMEN1KMT2AALDH1A1GAA | |
| Hydrochloric Acid SCHEMBL4711470 | 0.73 | GAA (0.59) | TSHRMEN1KMT2AALDH1A1LMNA | |
| SCHEMBL10696756 | 0.72 | MEN1 (0.46) | TSHRMEN1KMT2AALDH1A1LMNA | |
| SCHEMBL8911574 | 0.70 | CYP1A2 (0.49) | MEN1KMT2AALDH1A1GABRA1GABRB2 | |
| SCHEMBL396948 | 0.70 | CLEC4M (0.56) | TSHRMEN1KMT2AALDH1A1GAA | |
| SCHEMBL7552732 | 0.69 | GABRA1 (0.52) | TSHRGABRA1GABRB2GABRB1GABRA3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1144415-A2 | FUNCTIONALIZED HETEROCYCLES AS CHEMOKINE RECEPTOR MODULATORS | WARNER-LAMBERT COMPANY (US) | 2001-10-17 | — | — | EP | disclosed |
| WO-2000042045-A2 | FUNCTIONALIZED HETEROCYCLES AS CHEMOKINE RECEPTOR MODULATORS | WARNER-LAMBERT COMPANY (US) | 2000-07-20 | — | — | WO | disclosed |