Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.41 |
| ▸ | CPA1 | P15085 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19230448 | 1.00 | TRPA1 (0.44) | TRPA1MEN1KMT2AOPRM1OPRD1 | |
| SCHEMBL16743936 | 0.84 | ESR1 (0.56) | OPRM1OPRD1OPRK1ALDH1A1MAPT | |
| SCHEMBL18747135 | 0.84 | ESR1 (0.56) | OPRM1OPRD1OPRK1ALDH1A1MAPT | |
| SCHEMBL15778554 | 0.84 | ALDH1A1 (0.43) | MEN1KMT2AOPRM1OPRD1OPRK1 | |
| SCHEMBL684451 | 0.82 | ALDH1A1 (0.45) | MEN1KMT2AALDH1A1MAPTHTT | |
| SCHEMBL4745249 | 0.82 | ACACB (0.44) | MEN1KMT2AOPRM1OPRD1ALDH1A1 | |
| SCHEMBL13323473 | 0.82 | ALDH1A1 (0.45) | MEN1KMT2AALDH1A1MAPTHTT | |
| SCHEMBL12341937 | 0.81 | ALDH1A1 (0.59) | MEN1KMT2AALDH1A1MAPTHTT | |
| SCHEMBL8605469 | 0.81 | ALDH1A1 (0.59) | MEN1KMT2AALDH1A1MAPTHTT | |
| SCHEMBL890230 | 0.81 | ALDH1A1 (0.59) | MEN1KMT2AALDH1A1MAPTHTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017136708-A1 | SYNTHESIS AND COMPOSITION OF RAPAFUCIN LIBRARIES | THE JOHNS HOPKINS UNIVERSITY (US) | 2017-08-10 | — | — | WO | disclosed |