Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 7/20 | 0.42 |
| ▸ | NOS1 | P29475 | 7/20 | 0.42 |
| ▸ | NOS3 | P29474 | 5/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | DDAH1 | O94760 | 2/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | GSR | P00390 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14334652 | 0.76 | POLB (0.43) | POLBKMT2ATDP1ALOX5CYP2C19 | |
| SCHEMBL14335054 | 0.71 | KIF11 (0.40) | POLBKMT2ATDP1ALOX5CYP2C19 | |
| SCHEMBL8955926 | 0.69 | HDAC1 (0.38) | TSHRPOLBKMT2ATDP1ALOX5 | |
| SCHEMBL9130354 | 0.67 | KIF11 (0.39) | POLBKMT2ATDP1ALOX5CYP2C19 | |
| SCHEMBL9130364 | 0.67 | SLC1A3 (0.40) | POLBKMT2ATDP1ALOX5CYP2C19 | |
| SCHEMBL14335268 | 0.66 | POLB (0.43) | POLBKMT2ATDP1GSR | |
| SCHEMBL15450734 | 0.66 | NOS2 (0.58) | NOS2NOS1NOS3CYP1A2TSHR | |
| SCHEMBL19266739 | 0.66 | NOS2 (0.58) | NOS2NOS1NOS3CYP1A2TSHR | |
| SCHEMBL9093734 | 0.65 | HDAC1 (0.43) | TSHRPOLBALOX5CYP2C19GLA | |
| SCHEMBL9000597 | 0.65 | HDAC1 (0.43) | TSHRPOLBALOX5CYP2C19GLA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0707577-A4 | HEME BINDING COMPOUNDS AND USE THEREOF | WISCONSIN MED COLLEGE INC (US) | 1996-11-06 | — | — | EP | disclosed |
| EP-0707577-A1 | HEME BINDING COMPOUNDS AND USE THEREOF | MEDICAL COLLEGE OF WISCONSIN RESEARCH FOUNDATION, INC. (US) | 1996-04-24 | — | — | EP | disclosed |
| WO-1995001972-A1 | HEME BINDING COMPOUNDS AND USE THEREOF | THE MEDICAL COLLEGE OF WISCONSIN RESEARCH FOUNDATION, INC. (US) | 1995-01-19 | — | — | WO | disclosed |