Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GFER | P55789 | 1/20 | 0.54 |
| ▸ | MAOB | P27338 | 4/20 | 0.48 |
| ▸ | MAOA | P21397 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27576975 | 0.82 | GFER (0.59) | GFERMAOBMAOAALDH1A1CYP3A4 | |
| SCHEMBL17751262 | 0.80 | GFER (0.46) | GFERMAOBMAOAALDH1A1TSHR | |
| SCHEMBL10909669 | 0.80 | ESR1 (0.56) | ALDH1A1CYP3A4TSHRTDP1CYP19A1 | |
| SCHEMBL9577014 | 0.80 | CYP1A2 (0.48) | ALDH1A1TDP1FFAR1 | |
| SCHEMBL19217738 | 0.80 | LPL (0.48) | ALDH1A1CYP3A4CA1CA2FFAR1 | |
| SCHEMBL12327373 | 0.78 | AOC3 (0.47) | MAOBMAOAFFAR1 | |
| SCHEMBL1404834 | 0.78 | ALDH1A1 (0.63) | GFERMAOBMAOAALDH1A1CYP3A4 | |
| SCHEMBL27822625 | 0.78 | GFER (0.54) | GFERMAOBMAOAALDH1A1CYP3A4 | |
| SCHEMBL20712855 | 0.78 | GFER (0.48) | GFERMAOBMAOAALDH1A1CYP3A4 | |
| SCHEMBL2163306 | 0.77 | ALDH1A1 (0.61) | ALDH1A1TDP1RECQLFFAR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023077129-A1 | TETRAZINE CONJUGATES FOR IN VIVO TARGETED DELIVERY OF A PAYLOAD | TAMBO, INC. (US) | 2023-05-04 | — | — | WO | disclosed |
| WO-2022262789-A1 | ANTITUMOR COMPOUND AND USE THEREOF | 明慧医药（杭州）有限公司 | 2022-12-22 | — | — | WO | disclosed |
| EP-2558445-B1 | INTERMEDIATES USEFUL FOR THE SYNTHESIS OF PYRROLOBENZODIAZEPINES | MEDIMMUNE LTD (GB) | 2017-03-22 | — | — | EP | disclosed |