Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 5/20 | 0.44 |
| ▸ | CA12 | O43570 | 3/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | CA7 | P43166 | 3/20 | 0.44 |
| ▸ | CA9 | Q16790 | 3/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.44 |
| ▸ | CES1 | P23141 | 3/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | FASN | P49327 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | HCAR1 | Q9BXC0 | 3/20 | 0.37 |
| ▸ | GALR3 | O60755 | 1/20 | 0.37 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31554264 | 0.84 | CES2 (0.52) | CES2CA1CA2CES1GALR3 | |
| SCHEMBL31554270 | 0.84 | CES2 (0.52) | CES2CA1CA2CES1GALR3 | |
| SCHEMBL29422455 | 0.83 | CA12 (0.68) | CA12CA1CA2CA7CA9 | |
| SCHEMBL200289 | 0.83 | CA12 (0.68) | CA12CA1CA2CA7CA9 | |
| SCHEMBL25159913 | 0.81 | PARP1 (0.52) | CA12CA1CA2CA7CA9 | |
| SCHEMBL201236 | 0.81 | CA5A (0.70) | CA12CA1CA2CA7CA9 | |
| SCHEMBL18529821 | 0.78 | FASN (0.54) | CA12CA1CA2CA7CA9 | |
| SCHEMBL23395827 | 0.78 | MEN1 (0.50) | CA12CA1CA2CA7CA9 | |
| SCHEMBL2261587 | 0.76 | SMN1; SMN2 (0.41) | CA12CA1CA2CA7CA9 | |
| SCHEMBL15649255 | 0.76 | KDM4E (0.55) | MTORCYP3A4TDP1CTSLPOLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4797467-A | COPOLYMERS WITH AROMATIC DIOLS | BAYER AKTIENGESELLSCHAFT (DE) | 1989-01-10 | — | — | US | disclosed |
| US-4739058-A | USED IN BRANCHED POLYCARBONATES | BAYER AKTIENGESELLSCHAFT (DE) | 1988-04-19 | — | — | US | disclosed |
| EP-0207413-A1 | Tetra(hydroxyaryl)-bis-quinoxalines, their preparation and their use as branching agents in thermoplastic polycarbonates | BAYER AG (DE) | 1987-01-07 | — | — | EP | disclosed |