Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 7/20 | 0.63 |
| ▸ | ADRB1 | P08588 | 7/20 | 0.63 |
| ▸ | ADRB3 | P13945 | 7/20 | 0.63 |
| ▸ | LMNA | P02545 | 3/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.62 |
| ▸ | MAOA | P21397 | 2/20 | 0.62 |
| ▸ | MAPT | P10636 | 2/20 | 0.58 |
| ▸ | SCN1A | P35498 | 2/20 | 0.56 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.56 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.56 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7027777 | 0.98 | ADRB2 (0.65) | ADRB2ADRB1ADRB3LMNACYP1A2 | |
| SCHEMBL9148582 | 0.90 | MAPT (0.73) | ADRB2ADRB1ADRB3LMNACYP1A2 | |
| SCHEMBL9590886 | 0.90 | MAPT (0.73) | ADRB2ADRB1ADRB3LMNACYP1A2 | |
| Isobutamben SCHEMBL25178 | 0.87 | ADRB2 (0.65) | ADRB2ADRB1ADRB3LMNACYP1A2 | |
| SCHEMBL5935394 | 0.86 | ADRB2 (0.68) | ADRB2ADRB1ADRB3LMNACYP1A2 | |
| Isobutamben SCHEMBL4756252 | 0.86 | ADRB2 (0.63) | ADRB2ADRB1ADRB3LMNACYP1A2 | |
| SCHEMBL369461 | 0.83 | ADRB2 (0.60) | ADRB2ADRB1ADRB3LMNACYP1A2 | |
| SCHEMBL28545338 | 0.82 | MAPT (0.65) | ADRB2ADRB1ADRB3LMNACYP1A2 | |
| SCHEMBL11146237 | 0.81 | MAPT (0.83) | ADRB2ADRB1ADRB3MAPTTSHR | |
| SCHEMBL7210004 | 0.81 | ADRB2 (0.51) | ADRB2ADRB1ADRB3LMNACYP1A2 |
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-0677542-B1 | Diamine chain extenders in polyurethane-ureas and process of manufacture | AIR PROD & CHEM (US) | 1999-06-23 | — | — | EP | claimed |
| EP-0677542-A2 | Diamine chain extenders in polyurethane-ureas and process of manufacture | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1995-10-18 | — | — | EP | claimed |