Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CCR5 | P51681 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9519504 | 1.00 | ALDH1A1 (0.37) | ALDH1A1RAB9AMAPTHPGDNPC1 | |
| SCHEMBL8695032 | 0.92 | ALDH1A1 (0.36) | ALDH1A1RAB9AMAPTHPGDNPC1 | |
| SCHEMBL8924002 | 0.92 | ALDH1A1 (0.36) | ALDH1A1RAB9AMAPTHPGDNPC1 | |
| SCHEMBL8923996 | 0.92 | ALDH1A1 (0.37) | ALDH1A1RAB9AMAPTHPGDNPC1 | |
| SCHEMBL8695031 | 0.92 | ALDH1A1 (0.37) | ALDH1A1RAB9AMAPTHPGDNPC1 | |
| SCHEMBL8694255 | 0.87 | CCR5 (0.33) | ALDH1A1RAB9AMAPTHPGDNPC1 | |
| SCHEMBL9390647 | 0.87 | ALDH1A1 (0.36) | ALDH1A1MAPTHPGDKMT2ATDP1 | |
| SCHEMBL8694956 | 0.87 | ALDH1A1 (0.36) | ALDH1A1MAPTHPGDKMT2ATDP1 | |
| SCHEMBL8694954 | 0.87 | ALDH1A1 (0.36) | ALDH1A1MAPTHPGDTDP1CCR5 | |
| SCHEMBL9390642 | 0.87 | ALDH1A1 (0.36) | ALDH1A1MAPTHPGDTDP1CCR5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0280771-A1 | 3-Pyrrolidinylthio-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid derivatives and processes for the preparation thereof | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1988-09-07 | — | — | EP | disclosed |