Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 1.00 |
| ▸ | F13A1 | P00488 | 4/20 | 1.00 |
| ▸ | MAPT | P10636 | 3/20 | 1.00 |
| ▸ | PTGS1 | P23219 | 2/20 | 1.00 |
| ▸ | THRB | P10828 | 1/20 | 1.00 |
| ▸ | FASN | P49327 | 1/20 | 1.00 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 1.00 |
| ▸ | CNR1 | P21554 | 6/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.36 |
| ▸ | RXRA | P19793 | 2/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
| ▸ | OXER1 | Q8TDS5 | 2/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 4/20 | 0.33 |
| ▸ | TGM2 | P21980 | 3/20 | 0.31 |
| ▸ | F7 | P08709 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | F3 | P13726 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Cerulenin SCHEMBL20528755 | 1.00 | ALDH1A1 (1.00) | ALDH1A1F13A1MAPTPTGS1THRB | |
| Cerulenin SCHEMBL3183350 | 1.00 | ALDH1A1 (1.00) | ALDH1A1F13A1MAPTPTGS1THRB | |
| Cerulenin SCHEMBL8678332 | 1.00 | ALDH1A1 (1.00) | ALDH1A1F13A1MAPTPTGS1THRB | |
| Cerulenin SCHEMBL4450603 | 1.00 | ALDH1A1 (1.00) | ALDH1A1F13A1MAPTPTGS1THRB | |
| Cerulenin SCHEMBL41207 | 1.00 | ALDH1A1 (1.00) | ALDH1A1F13A1MAPTPTGS1THRB | |
| Cerulenin SCHEMBL28576416 | 1.00 | ALDH1A1 (1.00) | ALDH1A1F13A1MAPTPTGS1THRB | |
| Cerulenin SCHEMBL10387308 | 1.00 | ALDH1A1 (1.00) | ALDH1A1F13A1MAPTPTGS1THRB | |
| SCHEMBL12902003 | 0.85 | ALDH1A1 (0.74) | ALDH1A1F13A1MAPTPTGS1THRB | |
| SCHEMBL17874340 | 0.85 | ALDH1A1 (0.74) | ALDH1A1F13A1MAPTPTGS1THRB | |
| SCHEMBL9453468 | 0.81 | ALDH1A1 (0.68) | ALDH1A1F13A1MAPTPTGS1THRB |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5759837-A | ANTITUMOR AGENTS AND ANTICARCINOGENIC AGENTS | JOHN HOPKINS UNIVERSITY (US) | 1998-06-02 | — | — | US | disclosed |
| US-5614551-A | Inhibitors of fatty acid synthesis as antimicrobial agents | THE JOHNS HOPKINS UNIVERSITY (US) | 1997-03-25 | — | — | US | disclosed |
| US-5539132-A | Cerulenin compounds for fatty acid synthesis inhibition | JOHNS HOPKINS UNIVERSITY (US) | 1996-07-23 | — | — | US | disclosed |
| WO-1995019765-A1 | CERTAIN CERULENIN-GERANYL AND DODECANOIC ACID DERIVATIVES | CHEKTEC CORPORATION (US) | 1995-07-27 | — | — | WO | disclosed |
| EP-0651636-A1 | CHEMOTHERAPY FOR CANCER | THE JOHNS HOPKINS UNIVERSITY (US) | 1995-05-10 | — | — | EP | disclosed |
| WO-1994002108-A1 | CHEMOTHERAPY FOR CANCER | THE JOHNS HOPKINS UNIVERSITY (US) | 1994-02-03 | — | — | WO | disclosed |