Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPMT | P51580 | 1/20 | 0.55 |
| ▸ | SRD5A2 | P31213 | 5/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.43 |
| ▸ | RXRA | P19793 | 2/20 | 0.40 |
| ▸ | RXRB | P28702 | 2/20 | 0.40 |
| ▸ | RXRG | P48443 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.37 |
| ▸ | RARB | P10826 | 1/20 | 0.36 |
| ▸ | RARG | P13631 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 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 | |
|---|---|---|---|---|
| SCHEMBL2058690 | 0.92 | SRD5A2 (0.53) | TPMTSRD5A2RXRARXRBRXRG | |
| SCHEMBL8417608 | 0.92 | SRD5A2 (0.53) | TPMTSRD5A2RXRARXRBRXRG | |
| SCHEMBL2058451 | 0.90 | SRD5A2 (0.55) | TPMTSRD5A2RXRARXRBRXRG | |
| SCHEMBL30144881 | 0.86 | SRD5A2 (0.59) | TPMTSRD5A2RXRARXRBRXRG | |
| SCHEMBL8417563 | 0.84 | LMNA (0.35) | TRPV1 | |
| SCHEMBL30144875 | 0.84 | SRD5A2 (0.61) | TPMTSRD5A2RXRARXRBRXRG | |
| SCHEMBL21656836 | 0.81 | PARP15 (0.50) | SRD5A2RXRARXRBRXRGTSHR | |
| SCHEMBL16429445 | 0.80 | SRD5A2 (0.61) | TPMTSRD5A2RXRARXRBRXRG | |
| Perflubutane SCHEMBL28930534 | 0.78 | TSHR (0.63) | TPMTSRD5A2RXRARXRBRXRG | |
| SCHEMBL11055995 | 0.78 | SRD5A2 (0.53) | SRD5A2RXRARXRBRXRGTP53 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0245679-B1 | DEHALOGENATION PROCESS | ETHYL CORPORATION (US) | 1991-03-13 | — | — | EP | disclosed |
| US-4814497-A | Dehalogenation process | ETHYL CORPORATION (US) | 1989-03-21 | — | — | US | disclosed |
| EP-0245679-A2 | Dehalogenation process | ETHYL CORPORATION (US) | 1987-11-19 | — | — | EP | disclosed |