Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.56 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | DGAT1 | O75907 | 5/20 | 0.44 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL9256928 | 1.00 | IDO1 (0.56) | IDO1DRD2DGAT1SOAT1CYP2C9 | |
| SCHEMBL18380615 | 0.83 | CYP2C9 (0.44) | IDO1DGAT1SOAT1CYP2C9MAPT | |
| SCHEMBL28817040 | 0.83 | IDO1 (0.56) | IDO1DGAT1MAPTTP53DEGS1 | |
| Acetic Acid SCHEMBL28980245 | 0.82 | IDO1 (0.49) | IDO1DRD2CYP2C9MAPTLMNA | |
| SCHEMBL8726677 | 0.82 | CYP2C9 (0.47) | IDO1DGAT1SOAT1CYP2C9MAPT | |
| SCHEMBL8726682 | 0.82 | CYP2C9 (0.47) | IDO1DGAT1SOAT1CYP2C9MAPT | |
| SCHEMBL17731306 | 0.79 | IDO1 (0.77) | IDO1DRD2KMT2A | |
| Bicarbonate SCHEMBL1719769 | 0.78 | IDO1 (0.51) | IDO1DRD2CYP2C9MAPTLMNA | |
| Methyl Alcohol SCHEMBL15391253 | 0.78 | DRD2 (0.55) | IDO1DRD2CYP2C9MAPTLMNA | |
| SCHEMBL1835597 | 0.77 | IDO1 (0.49) | IDO1DRD2DGAT1SOAT1CYP2C9 |
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-5403934-A | Heterocyclic compounds | BURROUGHS WELLCOME CO. (US) | 1995-04-04 | — | — | US | disclosed |
| WO-1991013873-A1 | HETEROCYCLIC COMPOUNDS | THE WELLCOME FOUNDATION LIMITED (GB) | 1991-09-19 | — | — | WO | disclosed |
| EP-0447164-A1 | Heterocyclic compounds | THE WELLCOME FOUNDATION LIMITED (GB) | 1991-09-18 | — | — | EP | disclosed |