Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 3/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | PRKCI | P41743 | 1/20 | 0.42 |
| ▸ | HMGCR | P04035 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
| ▸ | CTSG | P08311 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9419304 | 0.96 | TYR (0.58) | TYRHTTALOX5MEN1TP53 | |
| SCHEMBL7761403 | 0.92 | PRKCI (0.47) | TYRHTTALOX5MEN1TP53 | |
| SCHEMBL9419270 | 0.91 | TYR (0.58) | TYRHTTALOX5MEN1TP53 | |
| SCHEMBL9405914 | 0.89 | TYR (0.61) | TYRHTTALOX5MEN1TP53 | |
| SCHEMBL10335524 | 0.89 | TYR (0.61) | TYRHTTALOX5MEN1TP53 | |
| SCHEMBL7475773 | 0.89 | TYR (0.61) | TYRHTTALOX5MEN1TP53 | |
| SCHEMBL9419377 | 0.89 | TYR (0.61) | TYRHTTALOX5MEN1TP53 | |
| SCHEMBL9723315 | 0.89 | TYR (0.61) | TYRHTTALOX5MEN1TP53 | |
| SCHEMBL9419375 | 0.89 | TYR (0.61) | TYRHTTALOX5MEN1TP53 | |
| SCHEMBL8746395 | 0.89 | TYR (0.61) | TYRHTTALOX5MEN1TP53 |
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-5087764-A | Deprotonation of a 1-substituted-2,3-difluorobenzene using an organometallic compound and reacting the reaction product with an electrophile | Merck Patent Gesellschaft mit beschrankter Hafung (DE) | 1992-02-11 | — | — | US | claimed |