Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 1/20 | 0.43 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.43 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | ADAMTS4 | O75173 | 4/20 | 0.35 |
| ▸ | MMP1 | P03956 | 4/20 | 0.35 |
| ▸ | MMP2 | P08253 | 4/20 | 0.35 |
| ▸ | MMP3 | P08254 | 4/20 | 0.35 |
| ▸ | MMP7 | P09237 | 4/20 | 0.35 |
| ▸ | MMP9 | P14780 | 4/20 | 0.35 |
| ▸ | MMP13 | P45452 | 4/20 | 0.35 |
| ▸ | MMP14 | P50281 | 4/20 | 0.35 |
| ▸ | ADAMTS5 | Q9UNA0 | 4/20 | 0.35 |
| ▸ | ADAM17 | P78536 | 3/20 | 0.35 |
| ▸ | F2RL3 | Q96RI0 | 2/20 | 0.33 |
| ▸ | MMP12 | P39900 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12676853 | 0.76 | METAP2 (0.54) | GRM4MAOAMAOBF2RL3ADRA2A | |
| SCHEMBL10901776 | 0.71 | FFAR1 (0.52) | PIM1PIM2MAOAFFAR1MAOB | |
| SCHEMBL785845 | 0.69 | KIF11 (0.45) | MAOB | |
| SCHEMBL30641500 | 0.68 | NOS3 (0.46) | PIM1PARP1 | |
| SCHEMBL3934909 | 0.68 | ESR1 (0.68) | PIM1PIM2MAOAFFAR1MAOB | |
| SCHEMBL1951809 | 0.68 | HPGD (0.38) | NFKB1PARP1 | |
| SCHEMBL311778 | 0.67 | IDO1 (0.54) | MAOB | |
| SCHEMBL30641506 | 0.66 | NPSR1 (0.45) | MAOB | |
| SCHEMBL14840456 | 0.66 | PIM1 (0.43) | PIM1PIM2GRM4MAOAFFAR1 | |
| SCHEMBL4659534 | 0.66 | GRM4 (0.49) | GRM4MAOAMAOBF2RL3ADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004069829-A1 | (2S)-2-((PYRIMIDIN-4-YL)AMINO)-4-METHYLPENTANOIC ACID AMINOETHYLAMID DERIVATIVES AS IL-8 RECEPTOR MODULATORS FOR THE TREATMENT OF ATHEROSCLEROSIS AND RHEUMATOID ARTHRITIS | PHARMACOPEIA DRUG DISCOVERY, INC. (US) | 2004-08-19 | — | — | WO | disclosed |
| WO-2004063192-A1 | IMIDAZOLYL PYRIMIDINE DERIVATIVES USEFUL AS IL-8 RECEPTOR MODULATORS | PHARMACOPEIA DRUG DISCOVERY, INC. (US) | 2004-07-29 | — | — | WO | disclosed |