Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | MMP2 | P08253 | 3/20 | 0.46 |
| ▸ | MMP9 | P14780 | 3/20 | 0.46 |
| ▸ | MMP8 | P22894 | 3/20 | 0.46 |
| ▸ | MMP12 | P39900 | 3/20 | 0.46 |
| ▸ | MMP13 | P45452 | 3/20 | 0.46 |
| ▸ | MMP14 | P50281 | 3/20 | 0.46 |
| ▸ | MMP16 | P51512 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1436731 | 0.81 | P2RX1 (0.57) | CA1CA2KDM4ECYP1A2CYP2C19 | |
| SCHEMBL8483740 | 0.80 | SMN1; SMN2 (0.59) | CA1CA2KDM4EMAPTHTT | |
| SCHEMBL16495950 | 0.78 | CA1 (0.51) | CA1CA2MMP2MMP9MMP8 | |
| SCHEMBL1562332 | 0.77 | NPC1 (0.68) | CA1CA2CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL16958941 | 0.71 | KDM4E (0.56) | CA1CA2KDM4ECYP1A2CYP2D6 | |
| SCHEMBL976321 | 0.70 | MEN1 (0.48) | KDM4EMAPTNPSR1HDAC8HPGD | |
| SCHEMBL10839189 | 0.70 | CA1 (0.70) | CA1CA2KDM4EHDAC8NPC1 | |
| SCHEMBL942259 | 0.70 | CA1 (1.00) | CA1CA2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL8478835 | 0.69 | SMN1; SMN2 (0.54) | CA1CA2KDM4EHPGDNPC1 | |
| SCHEMBL7502111 | 0.69 | HPGD (0.61) | KDM4ECYP1A2CYP2C19MAPTHTT |
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 |
|---|---|---|---|---|---|---|---|
| US-6482827-B1 | Matrix metalloproteinase inhibitors | PHARMACIA & UPJOHN S.P.A. (IT) | 2002-11-19 | — | — | US | disclosed |
| EP-0925289-A1 | MATRIX METALLOPROTEINASE INHIBITORS | PHARMACIA & UPJOHN S.p.A. (IT) | 1999-06-30 | — | — | EP | disclosed |
| WO-1999002510-A1 | MATRIX METALLOPROTEINASE INHIBITORS | PHARMACIA & UPJOHN S.P.A. (IT) | 1999-01-21 | — | — | WO | disclosed |