Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA4 | P22748 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 4/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.32 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TPMT | P51580 | 1/20 | 0.31 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9741779 | 0.76 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL9738931 | 0.73 | CYP19A1 (0.39) | HTR2AGRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL4852222 | 0.67 | CYP3A4 (0.32) | TSHR | |
| SCHEMBL3309764 | 0.67 | CA2 (0.45) | CA2CA4CA1CA6GRIN2D | |
| SCHEMBL9740482 | 0.66 | CA2 (0.44) | CA2CA4CA1CA6GRIN2D | |
| SCHEMBL9739991 | 0.66 | NQO2 (0.39) | CA2CA1HSD17B10ALDH1A1HPGD | |
| SCHEMBL9741890 | 0.66 | CYP19A1 (0.38) | HSD17B10ALDH1A1HPGDAPOBEC3AAPOBEC3G | |
| SCHEMBL28426250 | 0.65 | CA2 (0.58) | CA2CA4CA1CA6GRIN2D | |
| SCHEMBL3155331 | 0.62 | CA2 (0.54) | CA2CA4CA1CA6HTR2A | |
| SCHEMBL29726739 | 0.62 | CA2 (0.60) | CA2CA4CA1CA6GRIN2D |
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-5175157-A | Cardiovascular disorders | BOEHRINGER INGELHEIM GMBH (DE) | 1992-12-29 | — | — | US | disclosed |