Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.66 |
| ▸ | KARS1 | Q15046 | 4/20 | 0.66 |
| ▸ | MEN1 | O00255 | 3/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.66 |
| ▸ | TSHR | P16473 | 2/20 | 0.66 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.66 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.66 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.66 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.66 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.66 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.65 |
| ▸ | TP53 | P04637 | 1/20 | 0.65 |
| ▸ | MAPT | P10636 | 1/20 | 0.65 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.65 |
| ▸ | RXRA | P19793 | 1/20 | 0.65 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.65 |
| ▸ | CDK2 | P24941 | 1/20 | 0.65 |
| ▸ | RXRB | P28702 | 1/20 | 0.65 |
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 | |
|---|---|---|---|---|
| Dehydroabietinal SCHEMBL20866441 | 0.89 | KARS1 (0.67) | CYP3A4KARS1MEN1KMT2ATSHR | |
| Dehydroabietinal SCHEMBL2728308 | 0.89 | KARS1 (0.67) | CYP3A4KARS1MEN1KMT2ATSHR | |
| Dehydroabietinal SCHEMBL13660121 | 0.89 | KARS1 (0.67) | CYP3A4KARS1MEN1KMT2ATSHR | |
| Dehydroabietinal SCHEMBL2728310 | 0.89 | KARS1 (0.67) | CYP3A4KARS1MEN1KMT2ATSHR | |
| SCHEMBL6319708 | 0.85 | CYP3A4 (0.72) | CYP3A4KARS1MEN1KMT2ATSHR | |
| SCHEMBL6280790 | 0.85 | CYP3A4 (0.72) | CYP3A4KARS1MEN1KMT2ATSHR | |
| SCHEMBL15899658 | 0.85 | CYP3A4 (0.72) | CYP3A4KARS1MEN1KMT2ATSHR | |
| SCHEMBL20856766 | 0.83 | KARS1 (0.69) | CYP3A4KARS1MEN1KMT2ATSHR | |
| SCHEMBL20866406 | 0.82 | CYP3A4 (0.72) | CYP3A4KARS1MEN1KMT2ATSHR | |
| SCHEMBL134586 | 0.82 | CYP3A4 (0.69) | CYP3A4KARS1MEN1KMT2ATSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5075339-A | Antiinflammatory agents, antiallergens | DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1991-12-24 | — | — | US | disclosed |
| US-4948813-A | Benzylketone phospholipase A2 inhibitors | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1990-08-14 | — | — | US | disclosed |