Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAM17 | P78536 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 4/20 | 0.38 |
| ▸ | MMP1 | P03956 | 3/20 | 0.38 |
| ▸ | MMP3 | P08254 | 3/20 | 0.38 |
| ▸ | MMP7 | P09237 | 3/20 | 0.38 |
| ▸ | MMP9 | P14780 | 2/20 | 0.38 |
| ▸ | MMP8 | P22894 | 2/20 | 0.38 |
| ▸ | MMP13 | P45452 | 2/20 | 0.38 |
| ▸ | MMP14 | P50281 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.38 |
| ▸ | FCER2 | P06734 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | BMP1 | P13497 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6942897 | 0.87 | ADAM17 (0.40) | ADAM17ALDH1A1TSHRTP53LIMK2 | |
| SCHEMBL6940045 | 0.81 | KMT2A (0.34) | ADAM17ALDH1A1TSHRTP53HPGD | |
| SCHEMBL6940214 | 0.80 | ADAM17 (0.48) | ADAM17MMP2MMP1MMP3MMP7 | |
| SCHEMBL6941765 | 0.79 | ADAM17 (0.52) | ADAM17MMP2MMP1MMP3MMP7 | |
| SCHEMBL6939949 | 0.78 | ADAM17 (0.47) | ADAM17MMP2MMP1MMP3MMP7 | |
| SCHEMBL6945858 | 0.77 | ADAM17 (0.57) | ADAM17MMP2MMP1MMP3MMP7 | |
| SCHEMBL7076170 | 0.76 | MMP1 (0.49) | ADAM17TSHRMMP2MMP1MMP3 | |
| SCHEMBL6940945 | 0.76 | ADAM17 (0.75) | ADAM17MMP2MMP1MMP3MMP7 | |
| SCHEMBL8108691 | 0.75 | ADAM17 (0.46) | ADAM17MMP2MMP1MMP3MMP7 | |
| SCHEMBL6940260 | 0.74 | MMP2 (0.56) | ADAM17ALDH1A1MMP2MMP1MMP3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0993442-B1 | HYDRAZINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2003-04-23 | — | — | EP | disclosed |
| US-6235787-B1 | ANTIINFLAMMATORY AGENTS; RHEUMATIC DISEASES; BONE DISORDERS; SKIN DISORDERS; MULTIPLE SCLEROSIS | HOFFMANN-LA ROCHE INC. | 2001-05-22 | — | — | US | disclosed |