Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | ALPI | P09923 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | XIAP | P98170 | 1/20 | 0.35 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
| ▸ | ALPL | P05186 | 1/20 | 0.35 |
| ▸ | ALPG | P10696 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | MIF | P14174 | 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 | |
|---|---|---|---|---|
| SCHEMBL27946949 | 0.80 | TSHR (0.55) | POLBTSHRGABRA1GABRB2MAPK1 | |
| SCHEMBL5440489 | 0.77 | POLB (0.52) | POLBTSHRGABRA1GABRB2MAPK1 | |
| SCHEMBL6535408 | 0.76 | LMNA (0.44) | TSHRGABRA1GABRB2PTGS1MTNR1A | |
| SCHEMBL6535021 | 0.76 | POLB (0.47) | POLBTSHRGABRA1GABRB2MAPK1 | |
| SCHEMBL6534959 | 0.75 | TSHR (0.48) | POLBTSHRGABRA1GABRB2 | |
| SCHEMBL1838934 | 0.75 | POLB (0.50) | POLBTSHRGABRA1GABRB2MAPK1 | |
| SCHEMBL11620285 | 0.75 | MTNR1A (0.47) | EPHX1SIGMAR1MTNR1AMTNR1B | |
| SCHEMBL6535193 | 0.73 | PTGS2 (0.49) | POLBTSHRCYP1A2ALPIPKM | |
| SCHEMBL6534892 | 0.72 | TSHR (0.46) | POLBTSHRGABRA1GABRB2 | |
| SCHEMBL7998182 | 0.72 | TSHR (0.38) | POLBTSHRGABRA1GABRB2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6284918-B1 | ENZYME INHIBITORS | VANDERBILT UNIVERSITY | 2001-09-04 | — | — | US | disclosed |
| US-5973191-A | AN ACETOXYPHENYLALKYL SULFIDE, SALT OR HYDRATE | VANDERBILT UNIVERSITY (US) | 1999-10-26 | — | — | US | disclosed |