Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 6/20 | 0.50 |
| ▸ | UNG | P13051 | 1/20 | 0.37 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.37 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA7 | P43166 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3108438 | 0.89 | CA12 (0.44) | UNGCA12CA1CA2CA7 | |
| SCHEMBL10068717 | 0.85 | CA12 (0.44) | UNGCA12CA1CA2CA7 | |
| SCHEMBL1498158 | 0.82 | DHODH (0.65) | DHODHPARP15PARP10CA12CA1 | |
| SCHEMBL8366010 | 0.82 | DHODH (0.65) | DHODHPARP15PARP10CA12CA1 | |
| SCHEMBL3898643 | 0.80 | DHODH (0.63) | DHODHPARP15PARP10CA12CA1 | |
| SCHEMBL2724517 | 0.80 | KDM4E (0.42) | UNGCA12CA1CA2CA7 | |
| SCHEMBL16960960 | 0.78 | PARP1 (0.46) | PARP10MAPTHSD17B10TDP1TSHR | |
| SCHEMBL16961939 | 0.78 | PARP1 (0.46) | MAPTHSD17B10TDP1TSHRCYP3A4 | |
| SCHEMBL16951541 | 0.78 | PARP1 (0.46) | MAPTHSD17B10TDP1TSHRCYP3A4 | |
| SCHEMBL16962552 | 0.78 | PARP1 (0.33) | DHODHPARP10MAPTHSD17B10TDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1740575-A2 | PYRROLIDINE DERIVATIVES USEFUL AS BACE INHIBITORS | ELI LILLY AND COMPANY (US) | 2007-01-10 | — | — | EP | disclosed |
| WO-2005108358-A2 | PYRROLIDINE DERIVATIVES USEFUL AS BACE INHIBITORS | ELI LILLY AND COMPANY (US) | 2005-11-17 | — | — | WO | disclosed |