Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 2/20 | 0.34 |
| ▸ | GCGR | P47871 | 2/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | HEXA | P06865 | 1/20 | 0.33 |
| ▸ | HEXB | P07686 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15550742 | 0.89 | DHFR (0.43) | DHFRGCGRHSD11B1TSHR | |
| SCHEMBL8477966 | 0.86 | DHFR (0.38) | DHFRGCGRADORA3ADORA2AADORA1 | |
| SCHEMBL7464716 | 0.85 | GCGR (0.38) | GCGRADORA2AADORA1SMN1; SMN2KDM4E | |
| SCHEMBL8478421 | 0.85 | ALDH1A1 (0.36) | GCGRHEXAHEXBSMN1; SMN2ALDH1A1 | |
| SCHEMBL8477404 | 0.84 | TDP1 (0.38) | ALDH1A1HSD17B10MAPTHPGD | |
| SCHEMBL8477965 | 0.81 | MAPT (0.39) | HEXAHEXBMAPTPTGS2 | |
| SCHEMBL457404 | 0.79 | SMN1; SMN2 (0.36) | ADORA3ADORA2AADORA1SMN1; SMN2KDM4E | |
| SCHEMBL11040917 | 0.77 | CALM1 (0.38) | SMN1; SMN2ALDH1A1NPC1MAPTHPGD | |
| SCHEMBL7554815 | 0.75 | HSD11B1 (0.38) | HSD11B1 | |
| SCHEMBL8474110 | 0.73 | GCGR (0.35) | DHFRGCGRADORA3ADORA2AADORA1 |
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-6004988-A | Carboxylic acid derivatives, their preparation and their use | BASF AKTIENGESELLSCHAFT (DE) | 1999-12-21 | — | — | US | disclosed |