Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.48 |
| ▸ | AGXT | P21549 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.42 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.42 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Methylamine SCHEMBL27816806 | 1.00 | IDO1 (0.48) | IDO1AGXTTSHRALDH1A1CA1 | |
| Hydrazine SCHEMBL27604749 | 0.93 | IDO1 (0.50) | IDO1AGXTTSHRALDH1A1CA1 | |
| SCHEMBL503 | 0.93 | TSHR (0.52) | IDO1AGXTTSHRALDH1A1CA1 | |
| SCHEMBL901056 | 0.93 | TSHR (0.52) | IDO1AGXTTSHRALDH1A1CA1 | |
| Benzene SCHEMBL25178056 | 0.93 | TSHR (0.52) | IDO1AGXTTSHRALDH1A1CA1 | |
| Hydroxyamine SCHEMBL27588656 | 0.91 | ALDH1A1 (0.48) | IDO1AGXTTSHRALDH1A1CA1 | |
| Propane SCHEMBL27744553 | 0.91 | TSHR (0.46) | IDO1AGXTTSHRALDH1A1CA1 | |
| Water SCHEMBL28793674 | 0.91 | TSHR (0.50) | IDO1AGXTTSHRALDH1A1CA1 | |
| Hydrochloric Acid SCHEMBL4378719 | 0.91 | TSHR (0.50) | IDO1AGXTTSHRALDH1A1CA1 | |
| SCHEMBL28997098 | 0.91 | TSHR (0.50) | IDO1AGXTTSHRALDH1A1CA1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101068810-B | Carbostyril compound | OTSUKA PHARMA CO LTD | 2011-02-09 | — | — | CN | disclosed |
| CN-101068810-A | Carbostyril compound | OTSUKA PHARMA CO LTD (JP) | 2007-11-07 | — | — | CN | disclosed |
| CN-1636999-A | Benzobisazole-base compound | MITSUI CHEMICALS INC (JP) | 2005-07-13 | — | — | CN | disclosed |