Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.59 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.57 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.57 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.57 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | APEX1 | P27695 | 1/20 | 0.55 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.55 |
| ▸ | GLA | P06280 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 6/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.51 |
| ▸ | KCNK10 | P57789 | 1/20 | 0.51 |
| ▸ | ABL1 | P00519 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.50 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL109573 | 0.83 | KDM4E (0.60) | KDM4ETDP1AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL111313 | 0.82 | ALDH1A1 (0.76) | KDM4ETDP1AKR1C4AKR1C3AKR1C2 | |
| Hydrochloric Acid SCHEMBL15054390 | 0.81 | APEX1 (0.58) | KDM4ETDP1AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL28253565 | 0.81 | KMT2A (0.57) | KDM4ETDP1MAPTMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL143713 | 0.81 | APEX1 (0.58) | KDM4ETDP1AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL9513479 | 0.81 | MAPT (0.80) | TDP1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL17166275 | 0.81 | AKR1C2 (0.73) | KDM4ETDP1AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL5950315 | 0.80 | ALDH1A1 (0.74) | KDM4ETDP1AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL7540135 | 0.80 | LTC4S (0.51) | KDM4ETDP1AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL30499697 | 0.79 | KIF11 (0.51) | MAPTMEN1KMT2AALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002039987-A2 | USE OF MALARIA PARASITE ANION CHANNEL BLOCKERS FOR TREATING MALARIA | NEUROSEARCH A/S (DK) | 2002-05-23 | — | — | WO | disclosed |
| EP-1123274-A1 | SUBSTITUTED PHENYL DERIVATIVES, THEIR PREPARATION AND USE | NEUROSEARCH A/S (DK) | 2001-08-16 | — | — | EP | disclosed |
| WO-2000024707-A1 | SUBSTITUTED PHENYL DERIVATIVES, THEIR PREPARATION AND USE | NEUROSEARCH A/S (DK) | 2000-05-04 | — | — | WO | disclosed |