Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GALR3 | O60755 | 1/20 | 0.52 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | COMT | P21964 | 1/20 | 0.47 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3962616 | 0.83 | KDM4E (0.70) | ALDH1A1KDM4ESMN1; SMN2CYP2D6TDP1 | |
| Hydrochloric Acid SCHEMBL23850502 | 0.83 | KDM4E (0.60) | GALR3NR2F2ALDH1A1MEN1KMT2A | |
| SCHEMBL14699503 | 0.83 | KDM4E (0.70) | GALR3NR2F2ALDH1A1MEN1KMT2A | |
| SCHEMBL2094246 | 0.83 | CYP2A13 (0.66) | ALDH1A1MEN1KMT2ANPC1RAB9A | |
| SCHEMBL10714370 | 0.81 | CYP2A13 (0.71) | GALR3NR2F2ALDH1A1MEN1KMT2A | |
| SCHEMBL29694119 | 0.81 | ALDH1A1 (0.64) | GALR3NR2F2ALDH1A1MEN1KMT2A | |
| SCHEMBL592758 | 0.81 | ALDH1A1 (0.56) | GALR3NR2F2ALDH1A1MEN1KMT2A | |
| SCHEMBL3964348 | 0.80 | KDM4E (0.51) | ALDH1A1KDM4ESMN1; SMN2POLBCYP2D6 | |
| SCHEMBL6944544 | 0.78 | ACHE (0.48) | GALR3NR2F2ALDH1A1MEN1KMT2A | |
| SCHEMBL2095163 | 0.78 | KDM4E (0.61) | ALDH1A1MEN1KMT2AKDM4EPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010068881-A1 | NOVEL BENZODIOXANE AND BENZOXAZINE DERIVATIVES USEFUL AS CC CHEMOKINE RECEPTOR LIGANDS | FOREST LABORATORIES HOLDINGS LIMITED (BM) | 2010-06-17 | — | — | WO | claimed |