Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.51 |
| ▸ | CA1 | P00915 | 3/20 | 0.51 |
| ▸ | CA2 | P00918 | 3/20 | 0.51 |
| ▸ | CA7 | P43166 | 3/20 | 0.51 |
| ▸ | CA9 | Q16790 | 3/20 | 0.51 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.51 |
| ▸ | TNFRSF1A | P19438 | 2/20 | 0.47 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.46 |
| ▸ | UBE2N | P61088 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7944853 | 0.84 | TNFRSF1A (0.45) | TNFRSF1AGAALMNACYP3A4MEN1 | |
| SCHEMBL6918210 | 0.83 | CA2 (0.59) | CA12CA1CA2CA7CA9 | |
| SCHEMBL5677096 | 0.82 | TNFRSF1A (0.51) | CA12CA1CA2CA7CA9 | |
| SCHEMBL7933789 | 0.81 | SCN1A (0.47) | TNFRSF1AESR1LMNACYP3A4MEN1 | |
| SCHEMBL7933132 | 0.81 | CA12 (0.53) | CA12CA1CA2CA7CA9 | |
| SCHEMBL7933594 | 0.80 | SLC29A1 (0.47) | TNFRSF1AESR1LMNACYP3A4MEN1 | |
| Methylamine SCHEMBL8647392 | 0.80 | CA2 (0.56) | CA12CA1CA2CA7CA9 | |
| SCHEMBL7943237 | 0.80 | TNFRSF1A (0.40) | TNFRSF1AESR1GAALMNACYP3A4 | |
| SCHEMBL21376220 | 0.80 | HSD17B2 (0.61) | CA12CA1CA2CA7CA9 | |
| SCHEMBL27871656 | 0.79 | TNFRSF1A (0.49) | TNFRSF1AGAALMNACYP3A4MEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004026245-A2 | SUBSTITUTED PHOSPHONATE COMPOUNDS HAVING BONE ANABOLIC ACTIVITY | ILEX ONCOLOGY RESEARCH, SARL (CH) | 2004-04-01 | — | — | WO | disclosed |