Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 2/20 | 0.49 |
| ▸ | TYMP | P19971 | 1/20 | 0.46 |
| ▸ | IDH1 | O75874 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SHBG | P04278 | 1/20 | 0.41 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MPI | P34949 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2257130 | 0.85 | DAO (0.49) | DAOTYMPIDH1KDM4EALDH1A1 | |
| SCHEMBL11463465 | 0.77 | PNP (0.49) | DAOTYMPKDM4EALDH1A1CALM1 | |
| SCHEMBL2292345 | 0.77 | DAO (0.45) | DAOTYMPIDH1KDM4EALDH1A1 | |
| SCHEMBL31192183 | 0.74 | ALDH1A1 (0.68) | DAOTYMPKDM4EALDH1A1HSD17B10 | |
| SCHEMBL377487 | 0.74 | ALDH1A1 (0.68) | DAOTYMPKDM4EALDH1A1HSD17B10 | |
| SCHEMBL28313729 | 0.74 | CALM1 (0.58) | IDH1KDM4ELMNASHBGCALM1 | |
| SCHEMBL2254121 | 0.73 | CYP1A2 (0.45) | DAOTYMPKDM4EALDH1A1CALM1 | |
| SCHEMBL9190942 | 0.72 | CALM1 (0.55) | IDH1KDM4EALDH1A1LMNASHBG | |
| SCHEMBL3897557 | 0.72 | SMN1; SMN2 (0.48) | LMNASMN1; SMN2POLBPKMHPGD | |
| SCHEMBL5270175 | 0.72 | DAO (0.50) | DAOSMN1; SMN2HTT |
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-1414461-A4 | PYRAZINONE INHIBITORS OF FATTY ACID BINDING PROTEIN AND METHOD | BRISTOL MYERS SQUIBB CO (US) | 2005-10-26 | — | — | EP | disclosed |
| EP-1414461-A1 | PYRAZINONE INHIBITORS OF FATTY ACID BINDING PROTEIN AND METHOD | Bristol-Myers Squibb Company (US) | 2004-05-06 | — | — | EP | disclosed |
| WO-2003006023-A1 | PYRAZINONE INHIBITORS OF FATTY ACID BINDING PROTEIN AND METHOD | BRISTOL-MYERS SQUIBB COMPANY (US) | 2003-01-23 | — | — | WO | disclosed |