Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 5/20 | 0.40 |
| ▸ | CTSV | O60911 | 2/20 | 0.40 |
| ▸ | CTSL | P07711 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.38 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | PPIA | P62937 | 1/20 | 0.36 |
| ▸ | MYC | P01106 | 1/20 | 0.35 |
| ▸ | MAX | P61244 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | MGMT | P16455 | 1/20 | 0.35 |
| ▸ | MRGPRX4 | Q96LA9 | 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 | |
|---|---|---|---|---|
| SCHEMBL7430770 | 0.88 | CYP19A1 (0.42) | CYP19A1CTSVCTSLMEN1MAPT | |
| SCHEMBL6594485 | 0.85 | MTNR1A (0.39) | MAPTALDH1A1HTTLMNA | |
| SCHEMBL2434981 | 0.84 | ITGA4 (0.39) | CYP19A1CTSVCTSLMEN1MAPT | |
| SCHEMBL31321850 | 0.73 | LMNA (0.53) | CYP19A1CTSVCTSLMEN1MAPT | |
| SCHEMBL31667350 | 0.72 | CYP19A1 (0.52) | CYP19A1CTSVCTSLMEN1MAPT | |
| SCHEMBL2434879 | 0.72 | CYP19A1 (0.51) | CYP19A1CTSVCTSLMEN1MAPT | |
| SCHEMBL2432543 | 0.71 | CYP19A1 (0.44) | CYP19A1CTSVCTSLMEN1MAPT | |
| SCHEMBL6373720 | 0.70 | MYC (0.50) | CYP19A1CTSVCTSLMEN1MAPT | |
| SCHEMBL6373712 | 0.70 | MYC (0.50) | CYP19A1CTSVCTSLMEN1MAPT | |
| SCHEMBL22412563 | 0.70 | KDM1A (0.52) | CYP19A1CTSVCTSLMEN1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1133484-A2 | HETEROCYCLIC DERIVATIVES AND THEIR USE AS INTEGRIN INHIBITORS | AstraZeneca AB (SE) | 2001-09-19 | — | — | EP | disclosed |
| WO-2000005223-A2 | HETEROCYCLIC DERIVATIVES AND THEIR USE AS INTEGRIN INHIBITORS | ASTRAZENECA AB (SE) | 2000-02-03 | — | — | WO | disclosed |