Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.34 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.34 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.31 |
| ▸ | TUBB | P07437 | 1/20 | 0.31 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.31 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.31 |
| ▸ | TUBA4A | P68366 | 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 | |
|---|---|---|---|---|
| SCHEMBL5554313 | 0.86 | ABCB11 (0.38) | ABCB11PTGS2PTGS1AKR1C3AKR1C2 | |
| SCHEMBL5554035 | 0.85 | ABCB11 (0.33) | ABCB11TAS1R3TAS1R1TAS1R2KMT2A | |
| SCHEMBL5560622 | 0.85 | ABCB11 (0.33) | ABCB11TAS1R3TAS1R1TAS1R2PTGS2 | |
| SCHEMBL5556641 | 0.85 | ABCB11 (0.33) | ABCB11TAS1R3TAS1R1TAS1R2KMT2A | |
| SCHEMBL5558673 | 0.81 | PTGS2 (0.43) | ABCB11KMT2ALMNAMEN1PTGS2 | |
| SCHEMBL5559012 | 0.81 | — | — | |
| SCHEMBL5558850 | 0.76 | AKR1C3 (0.40) | ABCB11LMNAPTGS2PTGS1TP53 | |
| SCHEMBL5813595 | 0.74 | PTGS2 (0.46) | PTGS2PTGS1 | |
| SCHEMBL5558610 | 0.68 | PTGS2 (0.43) | ABCB11KMT2ALMNAMEN1PTGS2 | |
| SCHEMBL5554224 | 0.68 | AKR1C3 (0.35) | ABCB11KMT2ALMNAMEN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1643961-A4 | COX-2 AND FAAH INHIBITORS | MICROBIA INC (US) | 2007-09-12 | — | — | EP | disclosed |
| EP-1643961-A2 | COX-2 AND FAAH INHIBITORS | Microbia, Inc. (US) | 2006-04-12 | — | — | EP | disclosed |
| WO-2005002525-A2 | COX-2 AND FAAH INHIBITORS | MICROBIA, INC. (US) | 2005-01-13 | — | — | WO | disclosed |