Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | STS | P08842 | 7/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.41 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8615797 | 0.96 | TSHR (0.55) | TSHRTDP1L3MBTL1ALDH1A1MAPK1 | |
| SCHEMBL8620504 | 0.93 | ALDH1A1 (0.50) | TSHRTDP1L3MBTL1ALDH1A1MAPK1 | |
| SCHEMBL8613925 | 0.88 | TSHR (0.47) | TSHRTDP1L3MBTL1ALDH1A1TP53 | |
| SCHEMBL5569165 | 0.80 | HSD11B1 (0.47) | TSHRALDH1A1STSLMNAHSD17B10 | |
| SCHEMBL7297972 | 0.80 | STS (0.44) | TSHRTDP1L3MBTL1ALDH1A1MAPK1 | |
| SCHEMBL18489560 | 0.79 | TSHR (0.65) | TSHRTDP1L3MBTL1ALDH1A1MAPK1 | |
| SCHEMBL12788120 | 0.78 | STS (0.47) | TSHRL3MBTL1ALDH1A1TP53STS | |
| SCHEMBL5738305 | 0.77 | HSD11B1 (0.43) | TSHRALDH1A1STSHSD11B1 | |
| SCHEMBL11575811 | 0.77 | TSHR (0.58) | TSHRTDP1L3MBTL1ALDH1A1MAPK1 | |
| SCHEMBL4628206 | 0.76 | TSHR (0.65) | TSHRTDP1L3MBTL1ALDH1A1MAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0537879-B1 | Aryl triflate compound, radiologically acid producing agent, radiologically acid producing agent system, and radiosensitive composition | HITACHI CHEMICAL CO LTD (JP) | 1998-04-29 | — | — | EP | disclosed |
| US-5302725-A | Aryl triflate compounds and radiologically acid producing agents thereof | HITACHI CHEMICAL CO., LTD. (JP) | 1994-04-12 | — | — | US | disclosed |
| EP-0537879-A1 | Aryl triflate compound, radiologically acid producing agent, radiologically acid producing agent system, and radiosensitive composition | HITACHI CHEMICAL CO., LTD. (JP) | 1993-04-21 | — | — | EP | disclosed |
| US-5198402-A | ARYL TRIFLATE COMPOUND, RADIOLOGICALLY ACID PRODUCING AGENT, RADIOLOGICALLY ACID PRODUCING AGENT SYSTEM, AND RADIOSENSITIVE COMPOSITION | HITACHI CHEMICAL COMPANY LTD. (JP) | 1993-03-30 | — | — | US | disclosed |