Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 3/20 | 0.48 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.47 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | MMP14 | P50281 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | BCR | P11274 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CARM1 | Q86X55 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4720884 | 0.78 | LOXL2 (0.56) | ADRB2LOXL2PDPK1LTA4HCYP2A6 | |
| SCHEMBL468031 | 0.76 | PDPK1 (0.52) | ADRB2LOXL2PDPK1LTA4HSLC6A4 | |
| SCHEMBL4724672 | 0.75 | CYP2D6 (0.57) | ADRB2LOXL2PDPK1LTA4HKDM4E | |
| SCHEMBL4719960 | 0.75 | RAB9A (0.55) | ADRB2LOXL2PDPK1LTA4HKDM4E | |
| SCHEMBL30669210 | 0.75 | NQO1 (0.38) | MAPTSMN1; SMN2LMNA | |
| SCHEMBL28491243 | 0.74 | LOXL2 (0.53) | ADRB2LOXL2PDPK1LTA4HSLC6A4 | |
| SCHEMBL468161 | 0.74 | PDPK1 (0.57) | ADRB2LOXL2PDPK1CYP2A6SMPD3 | |
| SCHEMBL28579042 | 0.73 | PDPK1 (0.61) | ADRB2LOXL2PDPK1LTA4HSLC6A4 | |
| SCHEMBL722198 | 0.73 | PDPK1 (0.77) | ADRB2LOXL2PDPK1SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL27523094 | 0.73 | PDPK1 (0.55) | ADRB2LOXL2PDPK1SMPD3KDM4E |
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-4791200-A | ANTISECRETORY AGENTS | ORTHO PHARMACEUTICAL CORPORATION (US) | 1988-12-13 | — | — | US | disclosed |