Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8430880 | 0.89 | CA1 (0.37) | CA1CA2CA4ALDH1A1RXFP1 | |
| SCHEMBL8429048 | 0.88 | DHODH (0.36) | CA1CA2ALDH1A1KMT2ATSHR | |
| SCHEMBL8431176 | 0.86 | UBE2M (0.34) | CA1CA2CA4ALDH1A1RXFP1 | |
| SCHEMBL8429052 | 0.86 | PPARG (0.34) | CA1CA2CA4KMT2A | |
| SCHEMBL8431435 | 0.86 | CA1 (0.32) | CA1CA2CA4ALDH1A1RXFP1 | |
| SCHEMBL8431235 | 0.85 | RXFP1 (0.32) | CA1CA2CA4RXFP1KMT2A | |
| SCHEMBL8430809 | 0.85 | CA1 (0.32) | CA1CA2CA4ALDH1A1KMT2A | |
| SCHEMBL8429055 | 0.84 | TRPV4 (0.35) | CA1CA2CA4RXFP1KMT2A | |
| SCHEMBL8430969 | 0.83 | NR1H4 (0.33) | ALDH1A1KMT2AMAPTCYP1A2CYP3A4 | |
| SCHEMBL8430960 | 0.82 | MAPT (0.35) | ALDH1A1RXFP1KMT2AMAPTCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5952381-A | SELECTIVELY INHIBITING OR ANTAGONIZING THE INTEGRINS; ANTITUMOR AGENTS, ANTIARTHRITIC AGENTS, VIRICIDES, MICROBIOCIDES; TREATING OSTEOPOROSIS, SKIN DISORDERS | G. D. SEARLE & CO. (US) | 1999-09-14 | — | — | US | disclosed |